Vitas-M small molecule compound
6-({2-[(3-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK537130
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)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 C27H23BrN4O2S2 MW 579.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrN4O2S2/c1-16-7-3-4-10-21(16)32-26(34)24-17(2)30-27(20(14-29)25(24)22-11-6-12-35-22)36-15-23(33)31-19-9-5-8-18(28)13-19/h3-13,25,30H,15H2,1-2H3,(H,31,33)(H,32,34)InChIKey
VPURYLDBJQJHDW-UHFFFAOYSA-NSynonyms
6((2((3bromophenyl)amino)2oxoethyl)sulfanyl)5cyano2methylN(2methylphenyl)4(thiophen2yl)14dihydropyridine3carboxamide
6((2((3bromophenyl)amino)2oxoethyl)thio)5cyano2methyl4(thiophen2yl)N(otolyl)14dihydropyridine3carboxamide
6(2(3BROMOANILINO)2OXOETHYL)SULFANYL5CYANO2METHYLN(2METHYLPHENYL)4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CS3)C#N)SCC(=O)NC4=CC(=CC=C4)Br)C
InChI=1SC27H23BrN4O2S2c1167341021(16)3226(34)2417(2)3027(20(1429)25(24)22116123522)361523(33)311995818(28)1319h3132530H15H212H3(H3133)(H3234)
MFCD02241396
ZINC000001296500
ZINC000001296503
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