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Search results for: '177716-59-5'
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Poly[2-methoxy-5-(3′,7′-dimethyloctyloxy)-1,4-phenylenevinylene], D2-like dopamine receptor inverse agonist
Cas Number: 177716-59-5Synonyms: Eukystol | Sernel | Linton | Halopoidol | Galoperidol | Halojust | haloperidol | Aloperidin | Kesela...SMILES: C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(=O)C3=CC=C(C=C3)FInChIKey: LNEPOXFFQSENCJ-UHFFFAOYSA-NInChI: InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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5-R-Rivaroxaban
Cas Number: 865479-71-6Formula: C19H18ClN3O5SMolecular weight: 435.88Synonyms: BAY 59-7939 (Rivaroxaban) | Rivaroxaban R-isomer | BCP09021 | Rivaroxaban impurity A [EP] | BDBM1300...SMILES: C1COCC(=O)N1C2=CC=C(C=C2)N3CC(OC3=O)CNC(=O)C4=CC=C(S4)ClInChIKey: KGFYHTZWPPHNLQ-CQSZACIVSA-NInChI: InChI=1S/C19H18ClN3O5S/c20-16-6-5-15(29-16)18(25)21-9-14-10-23(19(26)28-14)13-3-1-12(2-4-13)22-7-8-27-11-17(22)24/h1-6,14H,7-11H2,(H,21,25)/t14-/m1/s1
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2-bromo-5-propoxy-pyrimidine
Cas Number: 1894032-59-7Formula: C7H9N2OBrMolecular weight: 217.06Synonyms: 2-bromo-5-propoxy-pyrimidine | 1894032-59-7 | PB41540 | F78269SMILES: CCCOC1=CN=C(N=C1)BrInChIKey: WVDKBWREYHIHMP-UHFFFAOYSA-NInChI: InChI=1S/C7H9BrN2O/c1-2-3-11-6-4-9-7(8)10-5-6/h4-5H,2-3H2,1H3
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5-Bromo-2-(dimethylamino)benzonitrile
Cas Number: 501086-59-5Formula: C9H9BrN2Molecular weight: 225.1Synonyms: 5-Bromo-2-(dimethylamino)benzonitrile|501086-59-5|SCHEMBL21741858|DTXSID60743087|BVA08659|MFCD216097...SMILES: CN(C)C1=C(C=C(C=C1)Br)C#NInChIKey: BOIXBQJIMKVCCD-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrN2/c1-12(2)9-4-3-8(10)5-7(9)6-11/h3-5H,1-2H3
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2-Bromo-5-(diethoxymethyl)-3-methylthiophene
Cas Number: 1000018-59-6Formula: C10H15BrO2SMolecular weight: 279.2Synonyms: 2-Bromo-5-(diethoxymethyl)-3-methylthiophene|1000018-59-6|Thiophene, 2-bromo-5-(diethoxymethyl)-3-me...SMILES: CCOC(C1=CC(=C(S1)Br)C)OCCInChIKey: XIHFWFIXJSZBPH-UHFFFAOYSA-NInChI: InChI=1S/C10H15BrO2S/c1-4-12-10(13-5-2)8-6-7(3)9(11)14-8/h6,10H,4-5H2,1-3H3
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7-iodo-5-methyl-pyrrolo[2,3-b]pyrazine
Cas Number: 2306270-59-5Formula: C7H6N3IMolecular weight: 259.05Synonyms: 7-iodo-5-methyl-pyrrolo[2,3-b]pyrazine | 2306270-59-5 | 7-iodo-5-methylpyrrolo[2,3-b]pyrazine | MFCD...SMILES: CN1C=C(C2=NC=CN=C21)IInChIKey: GXAIMZLSOFEBQB-UHFFFAOYSA-NInChI: InChI=1S/C7H6IN3/c1-11-4-5(8)6-7(11)10-3-2-9-6/h2-4H,1H3
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2-Bromo-6-ethoxyaniline
Cas Number: 1072945-59-5Formula: C8H10BrNOMolecular weight: 216.1Synonyms: 2-Bromo-6-ethoxyaniline|1072945-59-5|DTXSID80674804|XSB94559|MFCD11504835|AKOS015835113|SB77344|BS-2...SMILES: CCOC1=C(C(=CC=C1)Br)NInChIKey: BMRDKLUDXJPIFQ-UHFFFAOYSA-NInChI: InChI=1S/C8H10BrNO/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2,10H2,1H3
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4,6-Dimethoxypyrimidine-5-carbaldehyde
Cas Number: 4558-59-2Formula: C7H8N2O3Molecular weight: 168.15Synonyms: 4,6-dimethoxypyrimidine-5-carbaldehyde|4558-59-2|MFCD01912557|SCHEMBL1478136|4,6-Dimethoxy-5-formylp...SMILES: COC1=C(C(=NC=N1)OC)C=OInChIKey: WQGFZQFGVYDFOP-UHFFFAOYSA-NInChI: InChI=1S/C7H8N2O3/c1-11-6-5(3-10)7(12-2)9-4-8-6/h3-4H,1-2H3
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1-(3-Bromo-5-trifluoromethylphenylsulfonyl)pyrrolidine
Cas Number: 951884-59-6Formula: C11H11BrF3NO2SMolecular weight: 358.2Synonyms: 951884-59-6|1-((3-Bromo-5-(trifluoromethyl)phenyl)sulfonyl)pyrrolidine|1-(3-Bromo-5-trifluoromethylp...SMILES: C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)BrInChIKey: CQJNMANCWRRNDY-UHFFFAOYSA-NInChI: InChI=1S/C11H11BrF3NO2S/c12-9-5-8(11(13,14)15)6-10(7-9)19(17,18)16-3-1-2-4-16/h5-7H,1-4H2
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4-Bromo-5-ethoxy-2-nitroaniline
Cas Number: 1242336-59-9Formula: C8H9BrN2O3Molecular weight: 261.1Synonyms: 4-BROMO-5-ETHOXY-2-NITROANILINE|1242336-59-9|SCHEMBL16431683|DTXSID70681481|VZUYPQXQCGVAFU-UHFFFAOYS...SMILES: CCOC1=C(C=C(C(=C1)N)[N+](=O)[O-])BrInChIKey: VZUYPQXQCGVAFU-UHFFFAOYSA-NInChI: InChI=1S/C8H9BrN2O3/c1-2-14-8-4-6(10)7(11(12)13)3-5(8)9/h3-4H,2,10H2,1H3
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3,4-Dibromo-5-fluoropyridine
Cas Number: 1260843-59-1Formula: C5H2Br2FNMolecular weight: 254.88Synonyms: 3,4-Dibromo-5-fluoropyridine|1260843-59-1|Pyridine, 3,4-dibromo-5-fluoro-|MFCD13193300|DTXSID8071782...SMILES: C1=C(C(=C(C=N1)Br)Br)FInChIKey: KJVNORXSGJINCX-UHFFFAOYSA-NInChI: InChI=1S/C5H2Br2FN/c6-3-1-9-2-4(8)5(3)7/h1-2H
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5-chloro-3-iodo-1-methyl-pyrrolo[3,2-b]pyridine
Cas Number: 2231674-59-0Formula: C8H6N2ClIMolecular weight: 292.5Synonyms: 2231674-59-0 | 5-chloro-3-iodo-1-methyl-pyrrolo[3,2-b]pyridine | 5-chloro-3-iodo-1-methyl-1H-pyrrolo...SMILES: CN1C=C(C2=C1C=CC(=N2)Cl)IInChIKey: NHBYJOIMCWHBJC-UHFFFAOYSA-NInChI: InChI=1S/C8H6ClIN2/c1-12-4-5(10)8-6(12)2-3-7(9)11-8/h2-4H,1H3
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5-Formyl-2-(piperidin-1-yl)benzonitrile
Cas Number: 1272756-59-8Formula: C13H14N2OMolecular weight: 214.27Synonyms: AKOS015837480 | 1272756-59-8 | DTXSID501270019 | 5-formyl-2-(piperidin-1-yl)benzonitrile | Benzonitr...SMILES: C1CCN(CC1)C2=C(C=C(C=C2)C=O)C#NInChIKey: HJWIHIPVFJVJBS-UHFFFAOYSA-NInChI: InChI=1S/C13H14N2O/c14-9-12-8-11(10-16)4-5-13(12)15-6-2-1-3-7-15/h4-5,8,10H,1-3,6-7H2
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5-(Trifluoromethyl)-4-(trimethylsilyl)-1H-pyrrolo[2,3-b]pyridine
Cas Number: 1261365-59-6Formula: C11H13F3N2SiMolecular weight: 258.32Synonyms: MFCD18374148 | AKOS015852866 | 5-(Trifluoromethyl)-4-(trimethylsilyl)-1H-pyrrolo[2,3-b]pyridine | 12...SMILES: C[Si](C)(C)C1=C2C=CNC2=NC=C1C(F)(F)FInChIKey: FNUJUBLSTKUWMI-UHFFFAOYSA-NInChI: InChI=1S/C11H13F3N2Si/c1-17(2,3)9-7-4-5-15-10(7)16-6-8(9)11(12,13)14/h4-6H,1-3H3,(H,15,16)
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Demethylnobiletin
Cas Number: 2174-59-6Formula: C20H20O8Molecular weight: 388.38Synonyms: Demethylnobiletin|5-Demethylnobiletin|2174-59-6|5-O-Demethylnobiletin|5-O-Desmethylnobiletin|2-(3,4-...SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)OC)OC)O)OCInChIKey: DOFJNFPSMUCECH-UHFFFAOYSA-NInChI: InChI=1S/C20H20O8/c1-23-12-7-6-10(8-14(12)24-2)13-9-11(21)15-16(22)18(25-3)20(27-5)19(26-4)17(15)28-13/h6-9,22H,1-5H3
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2,6-Dibromo-3-fluoropyridine
Cas Number: 41404-59-5Formula: C5H2Br2FNMolecular weight: 254.88Synonyms: 2,6-DIBROMO-3-FLUOROPYRIDINE|41404-59-5|MFCD13185513|SCHEMBL1205413|DTXSID40680567|GOAOEPAQKOERAT-UH...SMILES: C1=CC(=NC(=C1F)Br)BrInChIKey: GOAOEPAQKOERAT-UHFFFAOYSA-NInChI: InChI=1S/C5H2Br2FN/c6-4-2-1-3(8)5(7)9-4/h1-2H
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5-Bromo-2′-deoxyuridine
Formula: C9H11BrN2O5Molecular weight: 307.1Synonyms: 5-BROMO-2'-DEOXYURIDINE|59-14-3|Broxuridine|Bromodeoxyuridine|5-Bromodeoxyuridine|5-BrdU|BRDU|BUDR|5...SMILES: C1C(C(OC1N2C=C(C(=O)NC2=O)Br)CO)OInChIKey: WOVKYSAHUYNSMH-RRKCRQDMSA-NInChI: InChI=1S/C9H11BrN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m0/s1
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3-cyclohexyl-4-nitro-1H-pyrazole
Cas Number: 1247187-59-2Formula: C9H13N3O2Molecular weight: 195.22Synonyms: 3-cyclohexyl-4-nitro-1H-pyrazole | 1247187-59-2 | 5-cyclohexyl-4-nitro-1H-pyrazole | MFCD14657971 | ...SMILES: C1CCC(CC1)C2=C(C=NN2)[N+](=O)[O-]InChIKey: SJYQTFKYTJTYOU-UHFFFAOYSA-NInChI: InChI=1S/C9H13N3O2/c13-12(14)8-6-10-11-9(8)7-4-2-1-3-5-7/h6-7H,1-5H2,(H,10,11)
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(5R)-5-amino-5-phenyl-pentanoic acid;hydrochloride
Cas Number: 1810074-59-9Formula: C11H16ClNO2Molecular weight: 229.7Synonyms: GS-7184 | (5R)-5-Amino-5-phenylpentanoic acid-hcl | (5R)-5-amino-5-phenylpentanoic acid;hydrochlorid...SMILES: C1=CC=C(C=C1)C(CCCC(=O)O)N.ClInChIKey: NIKOCFCSZXBQTK-HNCPQSOCSA-NInChI: InChI=1S/C11H15NO2.ClH/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9;/h1-3,5-6,10H,4,7-8,12H2,(H,13,14);1H/t10-;/m1./s1
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5-bromo-2-chloropyrrolo[2,1-f][1,2,4]triazine
Cas Number: 1233143-59-3Formula: C6H3BrClN3Molecular weight: 232.47Synonyms: 5-bromo-2-chloropyrrolo[2,1-f][1,2,4]triazine | MFCD22190557 | SCHEMBL10259135 | 1233143-59-3 | SY29...SMILES: C1=CN2C(=C1Br)C=NC(=N2)ClInChIKey: AXXQRRWVSIJWNS-UHFFFAOYSA-NInChI: InChI=1S/C6H3BrClN3/c7-4-1-2-11-5(4)3-9-6(8)10-11/h1-3H
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1-Methylpiperazine dihydrochloride
Cas Number: 34352-59-5Formula: C5H12N2 · 2HClMolecular weight: 173.08Synonyms: 1-Methylpiperazine dihydrochloride|34352-59-5|1-methylpiperazine;dihydrochloride|1-methylpiperazine ...SMILES: CN1CCNCC1.Cl.ClInChIKey: AILFRWRYZZVJTL-UHFFFAOYSA-NInChI: InChI=1S/C5H12N2.2ClH/c1-7-4-2-6-3-5-7;;/h6H,2-5H2,1H3;2*1H
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3-Methoxyisoxazole-5-carboxylic acid
Cas Number: 13626-59-0Formula: C5H5NO4Molecular weight: 143.1Synonyms: 3-Methoxyisoxazole-5-carboxylic acid|13626-59-0|3-METHOXY-ISOXAZOLE-5-CARBOXYLIC ACID|3-methoxy-1,2-...SMILES: COC1=NOC(=C1)C(=O)OInChIKey: WMMGHBYADJNEOC-UHFFFAOYSA-NInChI: InChI=1S/C5H5NO4/c1-9-4-2-3(5(7)8)10-6-4/h2H,1H3,(H,7,8)
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5-phenyl-1,3-thiazole-2-carbaldehyde
Cas Number: 862494-59-5Formula: C10H7NOSMolecular weight: 189.23Synonyms: 5-phenyl-1,3-thiazole-2-carbaldehyde|862494-59-5|5-PHENYLTHIAZOLE-2-CARBALDEHYDE|SCHEMBL3505055|5-ph...SMILES: C1=CC=C(C=C1)C2=CN=C(S2)C=OInChIKey: KOEXIFWBDMYROV-UHFFFAOYSA-NInChI: InChI=1S/C10H7NOS/c12-7-10-11-6-9(13-10)8-4-2-1-3-5-8/h1-7H
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5-Formylthiophene-3-boronic acid
Cas Number: 175592-59-3Formula: C5H5BO3SMolecular weight: 155.97Synonyms: 2-formylthiophene-4-boronic acid|175592-59-3|(5-formylthiophen-3-yl)boronic Acid|5-Formylthiophen-3-...SMILES: B(C1=CSC(=C1)C=O)(O)OInChIKey: ZCUFJAORCNFWOF-UHFFFAOYSA-NInChI: InChI=1S/C5H5BO3S/c7-2-5-1-4(3-10-5)6(8)9/h1-3,8-9H
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