methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(2-sulfanylidene-1H-pyridin-3-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(2-sulfanylidene-1H-pyridin-3-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(2-thioxo-1H-pyridin-3-yl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(2-sulfanylidene-1H-pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(2-sulfanylidene-1H-pyridin-3-yl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(2-thioxo-1H-pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CNC3=S

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CNC3=S

InChI

InChI=1S/C20H19N3O4S/c1-11-16(15-8-5-9-21-19(15)28)18(17(12(2)22-11)20(24)27-3)13-6-4-7-14(10-13)23(25)26/h4-10,18,22H,1-3H3,(H,21,28)