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Search results for: '1445-69-8'
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methyl 1,2,3,4-tetrahydroisoquinoline-7-carboxylate hydrochloride
Cas Number: 220247-69-8Formula: C11H14ClNO2Molecular weight: 227.69Synonyms: 220247-69-8|METHYL 1,2,3,4-TETRAHYDROISOQUINOLINE-7-CARBOXYLATE HYDROCHLORIDE|Methyl 1,2,3,4-tetrahy...SMILES: COC(=O)C1=CC2=C(CCNC2)C=C1.ClInChIKey: PUEZJQKDZBXXMM-UHFFFAOYSA-NInChI: InChI=1S/C11H13NO2.ClH/c1-14-11(13)9-3-2-8-4-5-12-7-10(8)6-9;/h2-3,6,12H,4-5,7H2,1H3;1H
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p-Aminosulfonyldihydrocinnamic acid
Cas Number: 90610-69-8Formula: C9H11NO4SMolecular weight: 229.3Synonyms: 3-(4-sulfamoylphenyl)propanoic acid|90610-69-8|3-(4-Sulfamoyl-phenyl)-propionic acid|p-Aminosulfonyl...SMILES: C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NInChIKey: JUEONDBIBADVGD-UHFFFAOYSA-NInChI: InChI=1S/C9H11NO4S/c10-15(13,14)8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H,11,12)(H2,10,13,14)
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3-Ethoxy-2,4,6-trifluorobenzeneboronic acid
Cas Number: 871125-69-8Formula: C8H8BF3O3Molecular weight: 219.95Synonyms: 871125-69-8|(3-Ethoxy-2,4,6-trifluorophenyl)boronic acid|3-Ethoxy-2,4,6-trifluorophenylboronic acid|...SMILES: B(C1=C(C(=C(C=C1F)F)OCC)F)(O)OInChIKey: SGJHUHAGELVQDV-UHFFFAOYSA-NInChI: InChI=1S/C8H8BF3O3/c1-2-15-8-5(11)3-4(10)6(7(8)12)9(13)14/h3,13-14H,2H2,1H3
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2,3,5-Trichloropyridin-4-amine
Cas Number: 28443-69-8Formula: C5H3Cl3N2Molecular weight: 197.45Synonyms: 2,3,5-trichloropyridin-4-amine|28443-69-8|4-Amino-2,3,5-trichloropyridine|2,3,5-Trichloro-4-pyridina...SMILES: C1=C(C(=C(C(=N1)Cl)Cl)N)ClInChIKey: YYJDUYUWQJWYNA-UHFFFAOYSA-NInChI: InChI=1S/C5H3Cl3N2/c6-2-1-10-5(8)3(7)4(2)9/h1H,(H2,9,10)
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(2R)-2-allylpyrrolidine-2-carboxylic acid;hydrochloride
Cas Number: 177206-69-8Formula: C8H14ClNO2Synonyms: 177206-69-8 | (R)-alpha-Allyl-proline hydrochloride | (2R)-2-prop-2-enylpyrrolidine-2-carboxylic aci...SMILES: C=CCC1(CCCN1)C(=O)O.ClInChIKey: DIYYEOOBZVTROL-QRPNPIFTSA-NInChI: InChI=1S/C8H13NO2.ClH/c1-2-4-8(7(10)11)5-3-6-9-8;/h2,9H,1,3-6H2,(H,10,11);1H/t8-;/m0./s1
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Mesoridazine besylate, Serotonin 2a (5-HT2a) receptor antagonist
Cas Number: 32672-69-8Formula: C21H26N2OS2・C6H6O3SMolecular weight: 544.75Synonyms: MESORIDAZINE BESYLATE|32672-69-8|Mesoridazine benzenesulfonate|mesoridazine besilate|NC 123|NSC-7600...SMILES: CN1CCCCC1CCN2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)C.C1=CC=C(C=C1)S(=O)(=O)OInChIKey: CRJHBCPQHRVYBS-UHFFFAOYSA-NInChI: InChI=1S/C21H26N2OS2.C6H6O3S/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23;7-10(8,9)6-4-2-1-3-5-6/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3;1-5H,(H,7,8,9)
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roniciclib, Cyclin-dependent kinase inhibitor
Cas Number: 1223498-69-8Formula: C18H21F3N4O3SMolecular weight: 430.44Synonyms: roniciclib | YYB49869 | BAY10-00394 | C92605 | (2R,3R)-3-((2-((4-(cyclopropanesulfonimidoyl)phenyl)a...SMILES: CC(C(C)OC1=NC(=NC=C1C(F)(F)F)NC2=CC=C(C=C2)S(=N)(=O)C3CC3)OInChIKey: UELYDGOOJPRWGF-MFOHZAOFSA-NInChI: InChI=1S/C18H21F3N4O3S/c1-10(26)11(2)28-16-15(18(19,20)21)9-23-17(25-16)24-12-3-5-13(6-4-12)29(22,27)14-7-8-14/h3-6,9-11,14,22,26H,7-8H2,1-2H3,(H,23,24,25)/t10-,11-,29?/m1/s1
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Flufenoxuron
Cas Number: 101463-69-8 EC Number: 417-680-3Formula: C21H11ClF6N2O3Molecular weight: 488.77Synonyms: Flufenoxuron|101463-69-8|Cascade|Flufenoxuron [ISO]|Benzamide, N-[[[4-[2-chloro-4-(trifluoromethyl)p...SMILES: C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=C(C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)F)FInChIKey: RYLHNOVXKPXDIP-UHFFFAOYSA-NInChI: InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)
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1-(3-Bromo-5-trifluoromethylphenylsulfonyl)piperidine
Cas Number: 951884-69-8Formula: C12H13BrF3NO2SMolecular weight: 372.2Synonyms: 951884-69-8|1-(3-Bromo-5-trifluoromethylphenylsulfonyl)piperidine|1-((3-Bromo-5-(trifluoromethyl)phe...SMILES: C1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)BrInChIKey: SCFQDFCQNPMZHX-UHFFFAOYSA-NInChI: InChI=1S/C12H13BrF3NO2S/c13-10-6-9(12(14,15)16)7-11(8-10)20(18,19)17-4-2-1-3-5-17/h6-8H,1-5H2
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penicillin G,Na
Cas Number: 69-57-8Formula: C16H17N2O4SNaMolecular weight: 356.37Synonyms: Penicillin G sodium|Penicillin G sodium salt|69-57-8|Benzylpenicillin sodium|Crystapen|BENZYLPENICIL...SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.[Na+]InChIKey: FCPVYOBCFFNJFS-LQDWTQKMSA-MInChI: InChI=1S/C16H18N2O4S.Na/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);/q;+1/p-1/t11-,12+,14-;/m1./s1
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2-Fluoropyridine-4-carboxaldehyde
Cas Number: 131747-69-8Formula: C6H4FNOMolecular weight: 125.1Synonyms: 2-Fluoroisonicotinaldehyde|131747-69-8|2-fluoropyridine-4-carbaldehyde|2-Fluoropyridine-4-carboxalde...SMILES: C1=CN=C(C=C1C=O)FInChIKey: WOLIMEQXFWSBTE-UHFFFAOYSA-NInChI: InChI=1S/C6H4FNO/c7-6-3-5(4-9)1-2-8-6/h1-4H
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N-(5-Dimethoxymethyl-pyridin-2-yl)-2,2-dimethyl-propionamide
Cas Number: 898561-69-8Formula: C13H20N2O3Molecular weight: 252.3Synonyms: 898561-69-8|N-(5-Dimethoxymethyl-pyridin-2-yl)-2,2-dimethyl-propionamide|N-(5-(DIMETHOXYMETHYL)PYRID...SMILES: CC(C)(C)C(=O)NC1=NC=C(C=C1)C(OC)OCInChIKey: KQNWRRORVRRBOU-UHFFFAOYSA-NInChI: InChI=1S/C13H20N2O3/c1-13(2,3)12(16)15-10-7-6-9(8-14-10)11(17-4)18-5/h6-8,11H,1-5H3,(H,14,15,16)
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2-Bromo-6-methylanisole
Cas Number: 52200-69-8Formula: C8H9BrOMolecular weight: 201.1Synonyms: 1-Bromo-2-methoxy-3-methylbenzene|52200-69-8|2-Bromo-6-methylanisole|3-Bromo-2-methoxytoluene|Benzen...SMILES: CC1=C(C(=CC=C1)Br)OCInChIKey: VUIUOSKXGNEORM-UHFFFAOYSA-NInChI: InChI=1S/C8H9BrO/c1-6-4-3-5-7(9)8(6)10-2/h3-5H,1-2H3
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4'-(Hydroxymethyl)biphenyl-3-carboxylic acid
Cas Number: 773872-69-8Formula: C14H12O3Molecular weight: 228.2Synonyms: 773872-69-8|4'-(Hydroxymethyl)-[1,1'-biphenyl]-3-carboxylic acid|4'-(Hydroxymethyl)biphenyl-3-carbox...SMILES: C1=CC(=CC(=C1)C(=O)O)C2=CC=C(C=C2)COInChIKey: ZOCJZYHNQJDOGC-UHFFFAOYSA-NInChI: InChI=1S/C14H12O3/c15-9-10-4-6-11(7-5-10)12-2-1-3-13(8-12)14(16)17/h1-8,15H,9H2,(H,16,17)
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4-cyclopropyl-1H-imidazole-2-carbonitrile hydrochloride
Cas Number: 2173991-69-8Synonyms: 4-cyclopropyl-1H-imidazole-2-carbonitrile hydrochloride | 2173991-69-8 | 2-cyano-4-cyclopropyl-1h-im...SMILES: C1CC1C2=CN=C(N2)C#N.ClInChIKey: ULYIAPUXACIQJJ-UHFFFAOYSA-NInChI: InChI=1S/C7H7N3.ClH/c8-3-7-9-4-6(10-7)5-1-2-5;/h4-5H,1-2H2,(H,9,10);1H
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tert-butyl 2,5-dioxa-8-azaspiro[3.5]nonane-8-carboxylate
Synonyms: 1272412-69-7|tert-butyl 2,5-dioxa-8-azaspiro[3.5]nonane-8-carboxylate|2,9-Dioxa-6-azaspiro[3.5]nonan...SMILES: CC(C)(C)OC(=O)N1CCOC2(C1)COC2InChIKey: UVTOWHCUNUQTLJ-UHFFFAOYSA-NInChI: InChI=1S/C11H19NO4/c1-10(2,3)16-9(13)12-4-5-15-11(6-12)7-14-8-11/h4-8H2,1-3H3
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Ac-Ala-OH
Formula: C5H9NO3Molecular weight: 131.13Synonyms: N-Acetyl-L-alanine|97-69-8|Ac-Ala-OH|N-ACETYLALANINE|acetyl-l-alanine|Acetylalanine|N-Acetyl-S-alani...SMILES: CC(C(=O)O)NC(=O)CInChIKey: KTHDTJVBEPMMGL-VKHMYHEASA-NInChI: InChI=1S/C5H9NO3/c1-3(5(8)9)6-4(2)7/h3H,1-2H3,(H,6,7)(H,8,9)/t3-/m0/s1
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[1-benzyl-4-(hydroxymethyl)azetidin-2-yl]methanol
Cas Number: 1263280-69-8 EC Number: 812-609-6Formula: C12H17NO2Molecular weight: 207.27Synonyms: cis-1-Benzyl-4-hydroxymethyl-azetidin-2-yl)-methanol | [(2R,4S)-1-BENZYL-4-(HYDROXYMETHYL)AZETIDIN-2...SMILES: C1C(N(C1CO)CC2=CC=CC=C2)COInChIKey: STVDKEPRJUNWSZ-UHFFFAOYSA-NInChI: InChI=1S/C12H17NO2/c14-8-11-6-12(9-15)13(11)7-10-4-2-1-3-5-10/h1-5,11-12,14-15H,6-9H2
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6-bromo-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-one
Cas Number: 1190861-69-8Formula: C11H12BrNOMolecular weight: 254.13Synonyms: 6-bromo-1,3,3-trimethylindolin-2-one | 1190861-69-8 | 6-bromo-1,3,3-trimethylindol-2-one | SCHEMBL12...SMILES: CC1(C2=C(C=C(C=C2)Br)N(C1=O)C)CInChIKey: SALXSOUNYQHQGF-UHFFFAOYSA-NInChI: InChI=1S/C11H12BrNO/c1-11(2)8-5-4-7(12)6-9(8)13(3)10(11)14/h4-6H,1-3H3
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N-Benzylmaleamic acid
Cas Number: 15329-69-8Formula: C11H11NO3Molecular weight: 205.2Synonyms: 15329-69-8|N-Benzylmaleamic acid|(Z)-4-(benzylamino)-4-oxobut-2-enoic acid|(Z)-4-Benzylamino-4-oxobu...SMILES: C1=CC=C(C=C1)CNC(=O)C=CC(=O)OInChIKey: BHWGQIYJCMMSNM-SREVYHEPSA-NInChI: InChI=1S/C11H11NO3/c13-10(6-7-11(14)15)12-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13)(H,14,15)/b7-6-
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methyl trans-3-amino-1-methoxy-cyclobutanecarboxylate;hydrochloride
Cas Number: 2231664-03-0Synonyms: 2231664-03-0 | 2231664-69-8 | trans-Methyl 3-amino-1-methoxycyclobutanecarboxylate hydrochloride | c...SMILES: COC(=O)C1(CC(C1)N)OC.ClInChIKey: MZUJMIIRXRVUBL-UHFFFAOYSA-NInChI: InChI=1S/C7H13NO3.ClH/c1-10-6(9)7(11-2)3-5(8)4-7;/h5H,3-4,8H2,1-2H3;1H
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tert-butyl (2R,5S)-2,5-dimethylpiperazine-1-carboxylate hydrochloride
Cas Number: 1523541-79-8Formula: C11H23ClN2O2Molecular weight: 250.77Synonyms: 792969-69-8 | (2R,5S)-1-Boc-2,5-dimethylpiperazine hydrochloride | 1523541-79-8 | (2R,5S)-tert-Butyl...SMILES: CC1CNC(CN1C(=O)OC(C)(C)C)C.ClInChIKey: TWALJKZSNHQOBH-OULXEKPRSA-NInChI: InChI=1S/C11H22N2O2.ClH/c1-8-7-13(9(2)6-12-8)10(14)15-11(3,4)5;/h8-9,12H,6-7H2,1-5H3;1H/t8-,9+;/m0./s1
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3-Bromo-2-(chloromethyl)pyridine
Cas Number: 122851-69-8Formula: C6H5BrClNMolecular weight: 206.5Synonyms: 3-bromo-2-(chloromethyl)pyridine|122851-69-8|Pyridine, 3-bromo-2-(chloromethyl)-|MFCD13189055|Pyridi...SMILES: C1=CC(=C(N=C1)CCl)BrInChIKey: FGRPSQGAABFCHF-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrClN/c7-5-2-1-3-9-6(5)4-8/h1-3H,4H2
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MX69
Cas Number: 1005264-47-0Formula: C27H26N2O4SMolecular weight: 474.57Synonyms: MX69|1005264-47-0|MX-69|4-[8-[(3,4-dimethylphenyl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]qu...SMILES: CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=CC=C(C=C5)C(=O)O)CInChIKey: XCBONKHCCRJMNW-UHFFFAOYSA-NInChI: InChI=1S/C27H26N2O4S/c1-16-6-11-20(14-17(16)2)29-34(32,33)21-12-13-25-24(15-21)22-4-3-5-23(22)26(28-25)18-7-9-19(10-8-18)27(30)31/h3-4,6-15,22-23,26,28-29H,5H2,1-2H3,(H,30,31)
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