Vitas-M small molecule compound
6-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-fluorophenyl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK827641
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=C(C1c1ccccc1F)C(=O)Nc1ccccc1OC)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 C29H24BrFN4O3S MW 607.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24BrFN4O3S/c1-17-26(28(37)35-23-9-5-6-10-24(23)38-2)27(20-7-3-4-8-22(20)31)21(15-32)29(33-17)39-16-25(36)34-19-13-11-18(30)12-14-19/h3-14,27,33H,16H2,1-2H3,(H,34,36)(H,35,37)InChIKey
UALFRUXETJVXNR-UHFFFAOYSA-NSynonyms
6((2((4bromophenyl)amino)2oxoethyl)sulfanyl)5cyano4(2fluorophenyl)N(2methoxyphenyl)2methyl14dihydropyridine3carboxamide
6(2(4bromoanilino)2oxoethyl)sulfanyl5cyano4(2fluorophenyl)N(2methoxyphenyl)2methyl14dihydropyridine3carboxamide
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)Br)C#N)C3=CC=CC=C3F)C(=O)NC4=CC=CC=C4OC
InChI=1SC29H24BrFN4O3Sc11726(28(37)35239561024(23)382)27(20734822(20)31)21(1532)29(3317)391625(36)3419131118(30)121419h3142733H16H212H3(H3436)(H3537)
MFCD10088164
ZINC000102719114
ZINC000102719118
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