diethyl 2-(3-methanoyloxy-3-pyridin-3-yl-propyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-(3-methanoyloxy-3-pyridin-3-yl-propyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-[3-formyloxy-3-(3-pyridyl)propyl]-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[3-formyloxy-3-(3-pyridinyl)propyl]-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(3-formyloxy-3-pyridin-3-ylpropyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[3-formyloxy-3-(3-pyridyl)propyl]-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C28H32N2O6S MolecularWeight: 524.62848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)SC)C(=O)OCC)CCC(C3=CN=CC=C3)OC=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)SC)C(=O)OCC)CCC(C3=CN=CC=C3)OC=O)C

InChI

InChI=1S/C28H32N2O6S/c1-5-34-27(32)24-18(3)30-22(12-13-23(36-17-31)20-10-8-14-29-16-20)26(28(33)35-6-2)25(24)19-9-7-11-21(15-19)37-4/h7-11,14-17,23,25,30H,5-6,12-13H2,1-4H3