dimethyl 1-(3-methylphenyl)-4-(4-methylsulfanylphenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-(3-methylphenyl)-4-(4-methylsulfanylphenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(4-methylsulfanylphenyl)-1-(m-tolyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(3-methylphenyl)-4-[4-(methylthio)phenyl]-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(3-methylphenyl)-4-(4-methylsulfanylphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-[4-(methylthio)phenyl]-1-(m-tolyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C(C(=C2)C(=O)OC)C3=CC=C(C=C3)SC)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C(C(=C2)C(=O)OC)C3=CC=C(C=C3)SC)C(=O)OC

InChI

InChI=1S/C23H23NO4S/c1-15-6-5-7-17(12-15)24-13-19(22(25)27-2)21(20(14-24)23(26)28-3)16-8-10-18(29-4)11-9-16/h5-14,21H,1-4H3