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Search results for: '736994-63-1'
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1,3-Propanediol
Formula: C3H8O2Molecular weight: 76.09Synonyms: 2-Deoxyglycerol | HSDB 8263 | J-503943 | CAS-504-63-2 | DTXCID6021246 | 1,3-PROPANEDIOL | 1,3-propan...SMILES: C(CO)COInChIKey: YPFDHNVEDLHUCE-UHFFFAOYSA-NInChI: InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2
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Ethyl 3-methyl-1-phenylpyrazole-5-carboxylate
Cas Number: 81153-63-1Formula: C13H14N2O2Molecular weight: 230.3Synonyms: 81153-63-1|Ethyl 3-methyl-1-phenylpyrazole-5-carboxylate|ethyl 3-methyl-1-phenyl-1H-pyrazole-5-carbo...SMILES: CCOC(=O)C1=CC(=NN1C2=CC=CC=C2)CInChIKey: XAKCPDKGPSNLDD-UHFFFAOYSA-NInChI: InChI=1S/C13H14N2O2/c1-3-17-13(16)12-9-10(2)14-15(12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3
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Myristic acid
Formula: C14H28O2Molecular weight: 228.37Synonyms: Tetradecanoic acid|MYRISTIC ACID|544-63-8|n-Tetradecanoic acid|Crodacid|n-Tetradecan-1-oic acid|n-Te...SMILES: CCCCCCCCCCCCCC(=O)OInChIKey: TUNFSRHWOTWDNC-UHFFFAOYSA-NInChI: InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)
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benzyl 2,5-diazabicyclo[4.1.0]heptane-2-carboxylate;hydrochloride
Cas Number: 2387602-63-1Synonyms: 2387602-63-1 | benzyl 2,5-diazabicyclo[4.1.0]heptane-2-carboxylate | hydrochloride | Benzyl 2,5-diaz...SMILES: C1CN(C2CC2N1)C(=O)OCC3=CC=CC=C3.ClInChIKey: QUZREJPDQWMGNE-UHFFFAOYSA-NInChI: InChI=1S/C13H16N2O2.ClH/c16-13(15-7-6-14-11-8-12(11)15)17-9-10-4-2-1-3-5-10;/h1-5,11-12,14H,6-9H2;1H
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Lobeline hydrochloride
Cas Number: 134-63-4Formula: C22H28ClNO2Molecular weight: 373.93Synonyms: LOBELINE HYDROCHLORIDE|134-63-4|2-(6-(2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethan...SMILES: CN1C(CCCC1CC(=O)C2=CC=CC=C2)CC(C3=CC=CC=C3)O.ClInChIKey: MKMYPTLXLWOUSO-UHFFFAOYSA-NInChI: InChI=1S/C22H27NO2.ClH/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;/h2-7,9-12,19-21,24H,8,13-16H2,1H3;1H
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4-(4-Bromopyrazol-1-yl)benzaldehyde
Cas Number: 1174064-63-1Formula: C10H7BrN2OMolecular weight: 251.1Synonyms: 4-(4-bromo-1H-pyrazol-1-yl)benzaldehyde|1174064-63-1|4-(4-Bromopyrazol-1-yl)benzaldehyde|SCHEMBL1532...SMILES: C1=CC(=CC=C1C=O)N2C=C(C=N2)BrInChIKey: WRORMQDKQSKVFB-UHFFFAOYSA-NInChI: InChI=1S/C10H7BrN2O/c11-9-5-12-13(6-9)10-3-1-8(7-14)2-4-10/h1-7H
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1-Methyl-3-[6-(methylthio)hexyl]imidazolium p-Toluenesulfonate
Cas Number: 1352947-63-7Formula: C18H28N2O3S2Molecular weight: 384.55Synonyms: SCHEMBL16968738 | MFCD23380210 | 1-Methyl-3-[6-(methylthio)hexyl]imidazolium p-Toluenesulfonate | M2...SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CN(C=C1)CCCCCCSCInChIKey: OVUBPNDERNKKQU-UHFFFAOYSA-MInChI: InChI=1S/C11H21N2S.C7H8O3S/c1-12-8-9-13(11-12)7-5-3-4-6-10-14-2;1-6-2-4-7(5-3-6)11(8,9)10/h8-9,11H,3-7,10H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
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1-(1H-Indazol-5-yl)ethanone
Cas Number: 1001906-63-3Formula: C9H8N2OMolecular weight: 160.176Synonyms: 1-(1H-Indazol-5-yl)ethanone|1001906-63-3|1-(1H-Indazol-5-yl)ethan-1-one|5-Acetyl-1H-indazole|Ethanon...SMILES: CC(=O)C1=CC2=C(C=C1)NN=C2InChIKey: WYLOAPVBIBQLJT-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O/c1-6(12)7-2-3-9-8(4-7)5-10-11-9/h2-5H,1H3,(H,10,11)
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1-BOC-4-(4-bromo-3,5-dimethylphenoxy)piperidine
Cas Number: 1072944-63-8Formula: C18H26BrNO3Molecular weight: 384.3Synonyms: 1072944-63-8|1-BOC-4-(4-bromo-3,5-dimethylphenoxy)piperidine|tert-Butyl 4-(4-bromo-3,5-dimethylpheno...SMILES: CC1=CC(=CC(=C1Br)C)OC2CCN(CC2)C(=O)OC(C)(C)CInChIKey: FTGLLUAQFRVJOF-UHFFFAOYSA-NInChI: InChI=1S/C18H26BrNO3/c1-12-10-15(11-13(2)16(12)19)22-14-6-8-20(9-7-14)17(21)23-18(3,4)5/h10-11,14H,6-9H2,1-5H3
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1-methyl-1,8-diazaspiro[4.5]decan-2-one;hydrochloride
Cas Number: 1380300-63-9Synonyms: KS-7358 | 1-Methyl-1,8-diazaspiro[4.5]decan-2-one HCl | CS-0067311 | SY119699 | AKOS027390787 | 1-Me...SMILES: CN1C(=O)CCC12CCNCC2.ClInChIKey: LJWYXKGGRCPQJQ-UHFFFAOYSA-NInChI: InChI=1S/C9H16N2O.ClH/c1-11-8(12)2-3-9(11)4-6-10-7-5-9;/h10H,2-7H2,1H3;1H
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2'-oxo-1',2'-dihydrospiro[cyclopropane-1,3'-indole]-5'-carbonitrile
Cas Number: 2093433-63-5Formula: C11H8N2OMolecular weight: 184.19Synonyms: 2093433-63-5 | 2'-oxo-1',2'-dihydrospiro[cyclopropane-1,3'-indole]-5'-carbonitrile | 2'-Oxospiro[cyc...SMILES: C1CC12C3=C(C=CC(=C3)C#N)NC2=OInChIKey: JIDKODOLBDHNQC-UHFFFAOYSA-NInChI: InChI=1S/C11H8N2O/c12-6-7-1-2-9-8(5-7)11(3-4-11)10(14)13-9/h1-2,5H,3-4H2,(H,13,14)
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1-tert-Butyl 3-methyl 4-amino-1H-pyrazole-1,3-dicarboxylate
Cas Number: 923283-63-0Formula: C10H15N3O4Molecular weight: 241.24Synonyms: 1-tert-Butyl 3-methyl 4-amino-1H-pyrazole-1,3-dicarboxylate|923283-63-0|1-O-tert-butyl 3-O-methyl 4-...SMILES: CC(C)(C)OC(=O)N1C=C(C(=N1)C(=O)OC)NInChIKey: NREJJSGJYLCPKQ-UHFFFAOYSA-NInChI: InChI=1S/C10H15N3O4/c1-10(2,3)17-9(15)13-5-6(11)7(12-13)8(14)16-4/h5H,11H2,1-4H3
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6-Methoxybenzofuran
Cas Number: 50551-63-8Formula: C9H8O2Molecular weight: 148.16Synonyms: 6-Methoxybenzofuran|50551-63-8|6-methoxy-1-benzofuran|ghl.PD_Mitscher_leg0.482|6-methoxy-benzofuran|...SMILES: COC1=CC2=C(C=C1)C=CO2InChIKey: ASYKSLFXWMWVIU-UHFFFAOYSA-NInChI: InChI=1S/C9H8O2/c1-10-8-3-2-7-4-5-11-9(7)6-8/h2-6H,1H3
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tert-butyl 3-(3-amino-1H-pyrazol-1-yl)azetidine-1-carboxylate
Cas Number: 1361386-63-1Formula: C11H18N4O2Molecular weight: 238.29Synonyms: tert-Butyl 3-(3-Amino-1H-pyrazol-1-yl)azetidine-1-carboxylate | 1361386-63-1 | tert-butyl 3-(3-amino...SMILES: CC(C)(C)OC(=O)N1CC(C1)N2C=CC(=N2)NInChIKey: PKYVWZDLZSTWHV-UHFFFAOYSA-NInChI: InChI=1S/C11H18N4O2/c1-11(2,3)17-10(16)14-6-8(7-14)15-5-4-9(12)13-15/h4-5,8H,6-7H2,1-3H3,(H2,12,13)
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Quinidine Sulfate, Sodium channel alpha subunit blocker
Formula: C40H48N4O4.H2SO4.2H2OMolecular weight: 782.94Synonyms: Quinidine sulfate dihydrate|6591-63-5|Quinidine sulfate|Cin-Quin|Quinidine sulfate hydrate|Quinidex ...SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.O.O.OS(=O)(=O)OInChIKey: ZHNFLHYOFXQIOW-AHSOWCEXSA-NInChI: See more
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N-Methyl-3,4-dimethoxybenzylamine
Cas Number: 63-64-9Formula: C10H15NO2Molecular weight: 181.24Synonyms: 63-64-9|(3,4-Dimethoxybenzyl)methylamine|N-Methyl-3,4-dimethoxybenzylamine|1-(3,4-dimethoxyphenyl)-N...SMILES: CNCC1=CC(=C(C=C1)OC)OCInChIKey: XQODFBIAQVJQHF-UHFFFAOYSA-NInChI: InChI=1S/C10H15NO2/c1-11-7-8-4-5-9(12-2)10(6-8)13-3/h4-6,11H,7H2,1-3H3
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D-Mannosamine hydrochloride
Formula: C6H14ClNO5Molecular weight: 215.63Synonyms: 5505-63-5|(2S,3R,4S,5R)-2-Amino-3,4,5,6-tetrahydroxyhexanal hydrochloride|D-Mannosamine HCl|D-Mannos...SMILES: C(C(C(C(C(C=O)N)O)O)O)O.ClInChIKey: CBOJBBMQJBVCMW-MVNLRXSJSA-NInChI: InChI=1S/C6H13NO5.ClH/c7-3(1-8)5(11)6(12)4(10)2-9;/h1,3-6,9-12H,2,7H2;1H/t3-,4-,5-,6-;/m1./s1
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1-Amino-2-naphthol-4-sulfonic Acid
Formula: C10H9NO4SMolecular weight: 239.25Synonyms: 116-63-2|1-Amino-2-naphthol-4-sulfonic acid|4-Amino-3-hydroxynaphthalene-1-sulfonic acid|4-Amino-3-h...SMILES: C1=CC=C2C(=C1)C(=CC(=C2N)O)S(=O)(=O)OInChIKey: RXCMFQDTWCCLBL-UHFFFAOYSA-NInChI: InChI=1S/C10H9NO4S/c11-10-7-4-2-1-3-6(7)9(5-8(10)12)16(13,14)15/h1-5,12H,11H2,(H,13,14,15)
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Itacitinib adipate
Cas Number: 1334302-63-4Formula: C32H33F4N9O5Molecular weight: 699.66Synonyms: A903004 | 1334302-63-4 | UNII-XZG407XE0Y | 3-azetidineacetonitrile,1-[1-[[3-fluoro-2-(trifluoromethy...SMILES: C1CN(CCC1N2CC(C2)(CC#N)N3C=C(C=N3)C4=C5C=CNC5=NC=N4)C(=O)C6=C(C(=NC=C6)C(F)(F)F)F.C(CCC(=O)O)CC(=O)OInChIKey: CEGWJIQFBNFMHQ-UHFFFAOYSA-NInChI: See more
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1-(3-Bromo-2,4-difluorophenyl)ethanone
Cas Number: 1210824-63-7Formula: C8H5BrF2OMolecular weight: 235.03Synonyms: FT-0687071 | 1210824-63-7 | EN300-1894844 | 3'-Bromo-2',4'-difluoroacetophenone | DS-17723 | SY03542...SMILES: CC(=O)C1=C(C(=C(C=C1)F)Br)FInChIKey: NOQZJPYTXYUMAU-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrF2O/c1-4(12)5-2-3-6(10)7(9)8(5)11/h2-3H,1H3
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4-(4-BOC-piperazinosulfonyl)bromobenzene
Cas Number: 259808-63-4Formula: C15H21BrN2O4SMolecular weight: 405.3Synonyms: 259808-63-4|4-(4-BOC-piperazinosulfonyl)bromobenzene|tert-Butyl 4-((4-bromophenyl)sulfonyl)piperazin...SMILES: CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)BrInChIKey: AQKVPXFKSGCQHL-UHFFFAOYSA-NInChI: InChI=1S/C15H21BrN2O4S/c1-15(2,3)22-14(19)17-8-10-18(11-9-17)23(20,21)13-6-4-12(16)5-7-13/h4-7H,8-11H2,1-3H3
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4-Fluoro-3-methylbenzene-1,2-diamine hydrochloride
Cas Number: 1161426-63-6Formula: C7H10ClFN2Molecular weight: 176.62Synonyms: 4-Fluoro-3-methylbenzene-1,2-diamine hydrochloride|1161426-63-6|4-fluoro-3-methylbenzene-1,2-diamine...SMILES: CC1=C(C=CC(=C1N)N)F.ClInChIKey: IKQNHVNODYROFA-UHFFFAOYSA-NInChI: InChI=1S/C7H9FN2.ClH/c1-4-5(8)2-3-6(9)7(4)10;/h2-3H,9-10H2,1H3;1H
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Ethyl 1-methyl-3-phenyl-1H-pyrazole-5-carboxylate
Cas Number: 10250-63-2Formula: C13H14N2O2Molecular weight: 230.26Synonyms: Ethyl 1-methyl-3-phenyl-1H-pyrazole-5-carboxylate|10250-63-2|ethyl 2-methyl-5-phenylpyrazole-3-carbo...SMILES: CCOC(=O)C1=CC(=NN1C)C2=CC=CC=C2InChIKey: JDJQHVJXMXXKFO-UHFFFAOYSA-NInChI: InChI=1S/C13H14N2O2/c1-3-17-13(16)12-9-11(14-15(12)2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
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benzyl (3S,4S)-4-amino-3-hydroxypiperidine-1-carboxylate
Cas Number: 1007596-63-5Formula: C13H18N2O3Molecular weight: 250.3Synonyms: 1007596-63-5 | (3S,4S)-benzyl 4-amino-3-hydroxypiperidine-1-carboxylate | benzyl (3s,4s)-4-amino-3-h...SMILES: C1CN(CC(C1N)O)C(=O)OCC2=CC=CC=C2InChIKey: IRKGMFWANMCSOS-RYUDHWBXSA-NInChI: InChI=1S/C13H18N2O3/c14-11-6-7-15(8-12(11)16)13(17)18-9-10-4-2-1-3-5-10/h1-5,11-12,16H,6-9,14H2/t11-,12-/m0/s1
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