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

Systemtic Name: O5-ethyl O3-methyl 2-methyl-4-(2-methylsulfanylphenyl)-6-(3-oxidanyl-3-phenyl-propyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 2-(3-hydroxy-3-phenyl-propyl)-6-methyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(3-hydroxy-3-phenylpropyl)-6-methyl-4-[2-(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-hydroxy-3-phenylpropyl)-6-methyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(3-hydroxy-3-phenyl-propyl)-6-methyl-4-[2-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C27H31NO5S MolecularWeight: 481.60374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2SC)C(=O)OC)C)CCC(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2SC)C(=O)OC)C)CCC(C3=CC=CC=C3)O

InChI

InChI=1S/C27H31NO5S/c1-5-33-27(31)25-20(15-16-21(29)18-11-7-6-8-12-18)28-17(2)23(26(30)32-3)24(25)19-13-9-10-14-22(19)34-4/h6-14,21,24,28-29H,5,15-16H2,1-4H3