diethyl 2-methyl-6-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-methyl-6-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-methyl-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-6-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C24H26N4O7S MolecularWeight: 514.55084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CSC3=NC(=O)C=C(N3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CSC3=NC(=O)C=C(N3)C)C

InChI

InChI=1S/C24H26N4O7S/c1-5-34-22(30)19-14(4)26-17(12-36-24-25-13(3)10-18(29)27-24)21(23(31)35-6-2)20(19)15-8-7-9-16(11-15)28(32)33/h7-11,20,26H,5-6,12H2,1-4H3,(H,25,27,29)