diethyl 2-methyl-6-methylsulfanyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-methyl-6-methylsulfanyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 2-methyl-6-methylsulfanyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate CAS Name: 2-methyl-6-(methylthio)-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-6-methylsulfanyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Traditional Name: 2-methyl-6-(methylthio)-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(C(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC)C)SC

Isomeric SMILES

CCOC(=O)C1=C(NC(C(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC)C)SC

InChI

InChI=1S/C19H24N2O6S/c1-5-26-17(22)15-11-19(18(23)27-6-2,12(3)20-16(15)28-4)13-7-9-14(10-8-13)21(24)25/h7-10,12,20H,5-6,11H2,1-4H3