Vitas-M small molecule compound
methyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK538038
SMILES N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1ccccc1Cl)C(=O)OC)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 C27H22ClN3O3S MW 504.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O3S/c1-16-24(27(33)34-2)25(20-9-5-6-10-22(20)28)21(14-29)26(30-16)35-15-23(32)31-19-12-11-17-7-3-4-8-18(17)13-19/h3-13,25,30H,15H2,1-2H3,(H,31,32)InChIKey
WJYVZPVCYCGHRB-UHFFFAOYSA-NSynonyms
369393-40-8369393408
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC3=CC=CC=C3C=C2)C#N)C4=CC=CC=C4Cl)C(=O)OC
InChI=1SC27H22ClN3O3Sc11624(27(33)342)25(209561022(20)28)21(1429)26(3016)351523(32)3119121117734818(17)1319h3132530H15H212H3(H3132)
methyl4(2chlorophenyl)5cyano2methyl6((2(naphthalen2ylamino)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
methyl4(2chlorophenyl)5cyano2methyl6((2(naphthalen2ylamino)2oxoethyl)thio)14dihydropyridine3carboxylate
METHYL4(2CHLOROPHENYL)5CYANO2METHYL6(2(NAPHTHALEN2YLAMINO)2OXOETHYL)SULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03000103
ZINC000020028840
ZINC000020028842
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