Vitas-M small molecule compound
prop-2-en-1-yl 6-[(2-amino-2-oxoethyl)sulfanyl]-4-[4-(benzyloxy)phenyl]-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826556
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)OCc1ccccc1)C#N)SCC(=O)N
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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 C26H25N3O4S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S/c1-3-13-32-26(31)23-17(2)29-25(34-16-22(28)30)21(14-27)24(23)19-9-11-20(12-10-19)33-15-18-7-5-4-6-8-18/h3-12,24,29H,1,13,15-16H2,2H3,(H2,28,30)InChIKey
WWCUGPBXXYQBRT-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OCC=C
InChI=1SC26H25N3O4Sc13133226(31)2317(2)2925(341622(28)30)21(1427)24(23)1991120(121019)3315187546818h3122429H1131516H22H3(H22830)
MFCD03980836
prop2en1yl6((2amino2oxoethyl)sulfanyl)4(4(benzyloxy)phenyl)5cyano2methyl14dihydropyridine3carboxylate
PROP2ENYL6(2AMINO2OXOETHYL)SULFANYL5CYANO2METHYL4(4PHENYLMETHOXYPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000003321559
ZINC000020347764
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