Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-2-{[3-cyano-4-(2-ethoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK886642
SMILES CCOc1ccccc1C1C(=C(SCC(=O)Nc2cccc(c2C)Cl)NC2=C1C(=O)CCC2)C#N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H26ClN3O3S MW 508.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S/c1-3-34-23-13-5-4-8-17(23)25-18(14-29)27(31-21-11-7-12-22(32)26(21)25)35-15-24(33)30-20-10-6-9-19(28)16(20)2/h4-6,8-10,13,25,31H,3,7,11-12,15H2,1-2H3,(H,30,33)InChIKey
DIMJDOLONFFQCO-UHFFFAOYSA-NSynonyms
370844-25-0370844250
CCOC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=C(C(=CC=C4)Cl)C)C#N
InChI=1SC27H26ClN3O3Sc1334231354817(23)2518(1429)27(31211171222(32)26(21)25)351524(33)3020106919(28)16(20)2h46810132531H37111215H212H3(H3033)
MFCD02999163
N(3chloro2methylphenyl)2((3cyano4(2ethoxyphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)acetamide
N(3chloro2methylphenyl)2((3cyano4(2ethoxyphenyl)5oxo145678hexahydroquinolin2yl)thio)acetamide
N(3chloro2methylphenyl)2((3cyano4(2ethoxyphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)acetamide
ZINC000002309509
ZINC000002309510
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