Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-4-(furan-2-yl)-2-methyl-6-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK550774
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]
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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 C23H20N4O6S MW 480.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O6S/c1-3-10-33-23(29)20-14(2)25-22(17(12-24)21(20)18-5-4-11-32-18)34-13-19(28)26-15-6-8-16(9-7-15)27(30)31/h3-9,11,21,25H,1,10,13H2,2H3,(H,26,28)InChIKey
UFHJIYQIMIZQRL-UHFFFAOYSA-NSynonyms
799770-28-8799770288
allyl5cyano4(furan2yl)2methyl6((2((4nitrophenyl)amino)2oxoethyl)thio)14dihydropyridine3carboxylate
C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)(N+)(=O)(O)
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)(N+)(=O)(O))C#N)C3=CC=CO3)C(=O)OCC=C
InChI=1SC23H20N4O6Sc13103323(29)2014(2)2522(17(1224)21(20)1854113218)341319(28)26156816(9715)27(30)31h39112125H11013H22H3(H2628)
MFCD03671425
prop2en1yl5cyano4(furan2yl)2methyl6((2((4nitrophenyl)amino)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
PROP2EN1YL5CYANO4FURAN2YL2METHYL6((2((4NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)14DIHYDROPYRIDINE3CARBOXYLATE
PROP2ENYL5CYANO4(FURAN2YL)2METHYL6(2(4NITROANILINO)2OXOETHYL)SULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020170651
ZINC000020170653
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