Vitas-M small molecule compound
5-cyano-N-(2-ethyl-6-methylphenyl)-4-(furan-2-yl)-2-methyl-6-[(2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethyl)sulfanyl]-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK885847
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)C(C)C)NC(=C(C1c1ccco1)C(=O)Nc1c(C)cccc1CC)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 C32H34N4O3S MW 554.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N4O3S/c1-6-22-10-7-9-20(4)30(22)36-31(38)28-21(5)34-32(25(17-33)29(28)26-11-8-16-39-26)40-18-27(37)35-24-14-12-23(13-15-24)19(2)3/h7-16,19,29,34H,6,18H2,1-5H3,(H,35,37)(H,36,38)InChIKey
CKKCVQNZSFWHBS-UHFFFAOYSA-NSynonyms
5cyanoN(2ethyl6methylphenyl)4(furan2yl)2methyl6((2oxo2((4(propan2yl)phenyl)amino)ethyl)sulfanyl)14dihydropyridine3carboxamide
5cyanoN(2ethyl6methylphenyl)4(furan2yl)2methyl6(2oxo2(4propan2ylanilino)ethyl)sulfanyl14dihydropyridine3carboxamide
CCC1=CC=CC(=C1NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC(=O)NC4=CC=C(C=C4)C(C)C)C)C
InChI=1SC32H34N4O3Sc1622107920(4)30(22)3631(38)2821(5)3432(25(1733)29(28)26118163926)401827(37)3524141223(131524)19(2)3h716192934H618H215H3(H3537)(H3638)
MFCD10086400
ZINC000098048660
ZINC000098048661
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