Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-2-methyl-6-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK887256
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)Nc1cccc(c1)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 C26H25N3O3S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S/c1-4-13-32-26(31)23-18(3)28-25(21(15-27)24(23)19-10-6-5-7-11-19)33-16-22(30)29-20-12-8-9-17(2)14-20/h4-12,14,24,28H,1,13,16H2,2-3H3,(H,29,30)InChIKey
AHOQMPNJGLDBIC-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3)C#N
InChI=1SC26H25N3O3Sc14133226(31)2318(3)2825(21(1527)24(23)19106571119)331622(30)2920128917(2)1420h412142428H11316H223H3(H2930)
MFCD10088106
prop2en1yl5cyano2methyl6((2((3methylphenyl)amino)2oxoethyl)sulfanyl)4phenyl14dihydropyridine3carboxylate
prop2enyl5cyano2methyl6(2(3methylanilino)2oxoethyl)sulfanyl4phenyl14dihydropyridine3carboxylate
ZINC000020348494
ZINC000020348496
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