Vitas-M small molecule compound
ethyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827302
SMILES CCOC(=O)CSC1=C(C#N)C(C(=C(N1)c1ccccc1)C(=O)OCC)c1ccco1
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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 C23H22N2O5S MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5S/c1-3-28-18(26)14-31-22-16(13-24)19(17-11-8-12-30-17)20(23(27)29-4-2)21(25-22)15-9-6-5-7-10-15/h5-12,19,25H,3-4,14H2,1-2H3InChIKey
IJYFNAXUBUQFOV-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=C(C(C(=C(N1)C2=CC=CC=C2)C(=O)OCC)C3=CC=CO3)C#Nethyl5cyano6((2ethoxy2oxoethyl)sulfanyl)4(furan2yl)2phenyl14dihydropyridine3carboxylate
ethyl5cyano6(2ethoxy2oxoethyl)sulfanyl4(furan2yl)2phenyl14dihydropyridine3carboxylate
Registry IDs
MFCD10087581ZINC000020348216
ZINC000020348218
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