Vitas-M small molecule compound
N-(4-chlorophenyl)-5-cyano-6-({2-[(3,4-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide
Catalog ID
STK538481
SMILES N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)Cl)NC(=C(C1c1ccncc1)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 C27H20Cl3N5O2S MW 584.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20Cl3N5O2S/c1-15-24(26(37)35-18-4-2-17(28)3-5-18)25(16-8-10-32-11-9-16)20(13-31)27(33-15)38-14-23(36)34-19-6-7-21(29)22(30)12-19/h2-12,25,33H,14H2,1H3,(H,34,36)(H,35,37)InChIKey
TWEXLUXBBVONCL-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=C(C=C2)Cl)Cl)C#N)C3=CC=NC=C3)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC27H20Cl3N5O2Sc11524(26(37)35184217(28)3518)25(168103211916)20(1331)27(3315)381423(36)34196721(29)22(30)1219h2122533H14H21H3(H3436)(H3537)
MFCD03000722
N(4chlorophenyl)5cyano6((2((34dichlorophenyl)amino)2oxoethyl)sulfanyl)2methyl14dihydro44bipyridine3carboxamide
N(4chlorophenyl)5cyano6((2((34dichlorophenyl)amino)2oxoethyl)thio)2methyl14dihydro(44bipyridine)3carboxamide
N(4CHLOROPHENYL)5CYANO6(2(34DICHLOROANILINO)2OXOETHYL)SULFANYL2METHYL4PYRIDIN4YL14DIHYDROPYRIDINE3CARBOXAMIDE
ZINC000001252156
ZINC000001252157
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