Vitas-M small molecule compound
5-cyano-2-methyl-6-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK838948
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)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 C27H24N4O2S2 MW 500.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N4O2S2/c1-17-8-6-11-20(14-17)30-23(32)16-35-27-21(15-28)25(22-12-7-13-34-22)24(18(2)29-27)26(33)31-19-9-4-3-5-10-19/h3-14,25,29H,16H2,1-2H3,(H,30,32)(H,31,33)InChIKey
BTNGJSWBONNKNF-UHFFFAOYSA-NSynonyms
5cyano2methyl6((2((3methylphenyl)amino)2oxoethyl)sulfanyl)Nphenyl4(thiophen2yl)14dihydropyridine3carboxamide
5cyano2methyl6((2oxo2(mtolylamino)ethyl)thio)Nphenyl4(thiophen2yl)14dihydropyridine3carboxamide
5CYANO2METHYL6(2(3METHYLANILINO)2OXOETHYL)SULFANYLNPHENYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC(=CC=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CS4)C#N
InChI=1SC27H24N4O2S2c117861120(1417)3023(32)16352721(1528)25(22127133422)24(18(2)2927)26(33)311994351019h3142529H16H212H3(H3032)(H3133)
MFCD02233729
ZINC000019939598
ZINC000019939602
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