Vitas-M small molecule compound
6-({2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
Catalog ID
STK538445
SMILES COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)nc(c1C(=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 C31H26Cl2N4O5S MW 637.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26Cl2N4O5S/c1-17-28(30(39)36-20-9-7-19(32)8-10-20)29(18-5-11-21(40-2)12-6-18)22(15-34)31(35-17)43-16-27(38)37-24-14-25(41-3)23(33)13-26(24)42-4/h5-14H,16H2,1-4H3,(H,36,39)(H,37,38)InChIKey
APYAETNXOGTYNI-UHFFFAOYSA-NSynonyms
6((2((4chloro25dimethoxyphenyl)amino)2oxoethyl)sulfanyl)N(4chlorophenyl)5cyano4(4methoxyphenyl)2methylpyridine3carboxamide
6((2((4chloro25dimethoxyphenyl)amino)2oxoethyl)thio)N(4chlorophenyl)5cyano4(4methoxyphenyl)2methylnicotinamide
6(2(4CHLORO25DIMETHOXYANILINO)2OXOETHYL)SULFANYLN(4CHLOROPHENYL)5CYANO4(4METHOXYPHENYL)2METHYLPYRIDINE3CARBOXAMIDE
CC1=C(C(=C(C(=N1)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC)C#N)C3=CC=C(C=C3)OC)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC31H26Cl2N4O5Sc11728(30(39)36209719(32)81020)29(1851121(402)12618)22(1534)31(3517)431627(38)37241425(413)23(33)1326(24)424h514H16H214H3(H3639)(H3738)
MFCD03000759
ZINC000097999931
ZINC97999931
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