Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-4-(furan-2-yl)-2-methyl-6-{[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827630
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1cccc2c1cccc2
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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 C27H23N3O4S MW 485.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O4S/c1-3-13-34-27(32)24-17(2)29-26(20(15-28)25(24)22-12-7-14-33-22)35-16-23(31)30-21-11-6-9-18-8-4-5-10-19(18)21/h3-12,14,25,29H,1,13,16H2,2H3,(H,30,31)InChIKey
HIDRWIGCPJUSOB-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CO4)C(=O)OCC=C
InChI=1SC27H23N3O4Sc13133427(32)2417(2)2926(20(1528)25(24)22127143322)351623(31)30211169188451019(18)21h312142529H11316H22H3(H3031)
MFCD10088156
prop2en1yl5cyano4(furan2yl)2methyl6((2(naphthalen1ylamino)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
prop2enyl5cyano4(furan2yl)2methyl6(2(naphthalen1ylamino)2oxoethyl)sulfanyl14dihydropyridine3carboxylate
ZINC000020348596
ZINC000020348598
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