diethyl 2-[3-azanyl-3-(4-methoxyphenyl)propyl]-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-[3-azanyl-3-(4-methoxyphenyl)propyl]-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-[3-amino-3-(4-methoxyphenyl)propyl]-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[3-amino-3-(4-methoxyphenyl)propyl]-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[3-amino-3-(4-methoxyphenyl)propyl]-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[3-amino-3-(4-methoxyphenyl)propyl]-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C29H36N2O5S MolecularWeight: 524.67154

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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=CC=C(C=C3)OC)N)C

Isomeric SMILES

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

InChI

InChI=1S/C29H36N2O5S/c1-6-35-28(32)25-18(3)31-24(16-15-23(30)19-11-13-21(34-4)14-12-19)27(29(33)36-7-2)26(25)20-9-8-10-22(17-20)37-5/h8-14,17,23,26,31H,6-7,15-16,30H2,1-5H3