Vitas-M small molecule compound
6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-cyano-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK725801
SMILES N#CC1=C(SCC(=O)c2ccc(cc2)Br)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)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 C27H22BrN3O2S2 MW 564.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrN3O2S2/c1-16-6-3-4-7-21(16)31-26(33)24-17(2)30-27(20(14-29)25(24)23-8-5-13-34-23)35-15-22(32)18-9-11-19(28)12-10-18/h3-13,25,30H,15H2,1-2H3,(H,31,33)InChIKey
JUXPCBHLXXQQQM-UHFFFAOYSA-NSynonyms
(6(2(4BROMOPHENYL)2OXOETHYLTHIO)5CYANO2METHYL4(2THIENYL)(314DIHYDROPYRIDYL))N(2METHYLPHENYL)CARBOXAMIDE
6((2(4bromophenyl)2oxoethyl)sulfanyl)5cyano2methylN(2methylphenyl)4(thiophen2yl)14dihydropyridine3carboxamide
6((2(4bromophenyl)2oxoethyl)thio)5cyano2methyl4(thiophen2yl)N(otolyl)14dihydropyridine3carboxamide
6(2(4BROMOPHENYL)2OXOETHYL)SULFANYL5CYANO2METHYLN(2METHYLPHENYL)4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CS3)C#N)SCC(=O)C4=CC=C(C=C4)Br)C
InChI=1SC27H22BrN3O2S2c116634721(16)3126(33)2417(2)3027(20(1429)25(24)2385133423)351522(32)1891119(28)121018h3132530H15H212H3(H3133)
MFCD01306808
ZINC000001900731
ZINC000059706099
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