3,4-dimethyl-N-(4-methylphenyl)-6-(4-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 3,4-dimethyl-N-(4-methylphenyl)-6-(4-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 3,4-dimethyl-6-(4-nitrophenyl)-N-(p-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 3,4-dimethyl-N-(4-methylphenyl)-6-(4-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 3,4-dimethyl-N-(4-methylphenyl)-6-(4-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 3,4-dimethyl-6-(4-nitrophenyl)-N-(p-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(N(C(=S)NC2C3=CC=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(N(C(=S)NC2C3=CC=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H20N4O3S/c1-12-4-8-15(9-5-12)21-19(25)17-13(2)23(3)20(28)22-18(17)14-6-10-16(11-7-14)24(26)27/h4-11,18H,1-3H3,(H,21,25)(H,22,28)