ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(4-methoxycarbonylphenyl)-6-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(4-carbomethoxyphenyl)-5-cyano-6-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C27H26N2O6S MolecularWeight: 506.57014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C(=O)OC)C#N)SCC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C(=O)OC)C#N)SCC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C27H26N2O6S/c1-5-35-27(32)23-16(2)29-25(36-15-22(30)17-10-12-20(33-3)13-11-17)21(14-28)24(23)18-6-8-19(9-7-18)26(31)34-4/h6-13,24,29H,5,15H2,1-4H3