Vitas-M small molecule compound
5-cyano-6-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK535641
SMILES N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccccc1)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 C31H30N4O3S MW 538.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O3S/c1-19-14-15-20(2)25(16-19)34-27(36)18-39-31-23(17-32)29(22-10-6-5-7-11-22)28(21(3)33-31)30(37)35-24-12-8-9-13-26(24)38-4/h5-16,29,33H,18H2,1-4H3,(H,34,36)(H,35,37)InChIKey
LVUFHGMTWLPEHY-UHFFFAOYSA-NSynonyms
5cyano6((2((25dimethylphenyl)amino)2oxoethyl)sulfanyl)N(2methoxyphenyl)2methyl4phenyl14dihydropyridine3carboxamide
5cyano6((2((25dimethylphenyl)amino)2oxoethyl)thio)N(2methoxyphenyl)2methyl4phenyl14dihydropyridine3carboxamide
5CYANO6(2(25DIMETHYLANILINO)2OXOETHYL)SULFANYLN(2METHOXYPHENYL)2METHYL4PHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC(=C(C=C1)C)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3OC)C4=CC=CC=C4)C#N
InChI=1SC31H30N4O3Sc119141520(2)25(1619)3427(36)18393123(1732)29(22106571122)28(21(3)3331)30(37)352412891326(24)384h5162933H18H214H3(H3436)(H3537)
MFCD02236860
ZINC000097950450
ZINC000097950451
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