Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-2-methyl-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK839622
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1c(C)cc(cc1C)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 C26H27N3O3S2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S2/c1-6-9-32-26(31)22-18(5)28-25(19(13-27)23(22)20-8-7-10-33-20)34-14-21(30)29-24-16(3)11-15(2)12-17(24)4/h6-8,10-12,23,28H,1,9,14H2,2-5H3,(H,29,30)InChIKey
IYQCTKYIHMHKPY-UHFFFAOYSA-NSynonyms
384357-39-5384357395
allyl5cyano6((2(mesitylamino)2oxoethyl)thio)2methyl4(thiophen2yl)14dihydropyridine3carboxylate
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CS3)C#N)C
InChI=1SC26H27N3O3S2c1693226(31)2218(5)2825(19(1327)23(22)2087103320)341421(30)292416(3)1115(2)1217(24)4h6810122328H1914H225H3(H2930)
MFCD03000961
prop2en1yl5cyano2methyl6((2oxo2((246trimethylphenyl)amino)ethyl)sulfanyl)4(thiophen2yl)14dihydropyridine3carboxylate
PROP2ENYL5CYANO2METHYL6(2OXO2(246TRIMETHYLANILINO)ETHYL)SULFANYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020029140
ZINC000020029142
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