O3-ethyl O5-methyl 2-(3-formamido-3-phenyl-propyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-methyl 2-(3-formamido-3-phenyl-propyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 2-(3-formamido-3-phenyl-propyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(3-formamido-3-phenylpropyl)-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl 2-(3-formamido-3-phenylpropyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(3-formamido-3-phenyl-propyl)-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C28H32N2O5S MolecularWeight: 508.62908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O5S/c1-5-35-28(33)26-23(15-14-22(29-17-31)19-10-7-6-8-11-19)30-18(2)24(27(32)34-3)25(26)20-12-9-13-21(16-20)36-4/h6-13,16-17,22,25,30H,5,14-15H2,1-4H3,(H,29,31)