Vitas-M small molecule compound
benzyl ({5-[(4-chlorophenyl)carbamoyl]-3-cyano-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Catalog ID
STK825536
SMILES N#CC1=C(SCC(=O)OCc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1)Cl)C
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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 C27H22ClN3O4S MW 520.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O4S/c1-17-24(26(33)31-20-11-9-19(28)10-12-20)25(22-8-5-13-34-22)21(14-29)27(30-17)36-16-23(32)35-15-18-6-3-2-4-7-18/h2-13,25,30H,15-16H2,1H3,(H,31,33)InChIKey
WUYSWHWKUKYXLI-UHFFFAOYSA-NSynonyms
benzyl((5((4chlorophenyl)carbamoyl)3cyano4(furan2yl)6methyl14dihydropyridin2yl)sulfanyl)acetate
BENZYL((5((4CHLOROPHENYL)CARBAMOYL)3CYANO4FURAN2YL6METHYL14DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
BENZYL2((5((4CHLOROPHENYL)CARBAMOYL)3CYANO4(FURAN2YL)6METHYL14DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
benzyl2((5((4chlorophenyl)carbamoyl)3cyano4(furan2yl)6methyl14dihydropyridin2yl)thio)acetate
CC1=C(C(C(=C(N1)SCC(=O)OCC2=CC=CC=C2)C#N)C3=CC=CO3)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC27H22ClN3O4Sc11724(26(33)312011919(28)101220)25(2285133422)21(1429)27(3017)361623(32)3515186324718h2132530H1516H21H3(H3133)
MFCD02239041
ZINC000009311103
ZINC000009311107
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