Vitas-M small molecule compound
6-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK885886
SMILES N#CC1=C(SCC(=O)c2ccc(cc2)Cl)NC(=C(C1c1ccc(c(c1)OC)O)C(=O)Nc1ccccc1)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 C29H24ClN3O4S MW 546.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O4S/c1-17-26(28(36)33-21-6-4-3-5-7-21)27(19-10-13-23(34)25(14-19)37-2)22(15-31)29(32-17)38-16-24(35)18-8-11-20(30)12-9-18/h3-14,27,32,34H,16H2,1-2H3,(H,33,36)InChIKey
NEYMNDOXCZVCEF-UHFFFAOYSA-NSynonyms
6((2(4chlorophenyl)2oxoethyl)sulfanyl)5cyano4(4hydroxy3methoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
6(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL5CYANO4(4HYDROXY3METHOXYPHENYL)2METHYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)Cl)C#N)C3=CC(=C(C=C3)O)OC)C(=O)NC4=CC=CC=C4
InChI=1SC29H24ClN3O4Sc11726(28(36)33216435721)27(19101323(34)25(1419)372)22(1531)29(3217)381624(35)1881120(30)12918h314273234H16H212H3(H3336)
MFCD04218797
ZINC000001113937
ZINC000001113939
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