3-(4-methoxyphenyl)-4-methyl-N-(3-nitrophenyl)-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-4-methyl-N-(3-nitrophenyl)-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 3-(4-methoxyphenyl)-4-methyl-N-(3-nitrophenyl)-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 3-(4-methoxyphenyl)-4-methyl-N-(3-nitrophenyl)-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 3-(4-methoxyphenyl)-4-methyl-N-(3-nitrophenyl)-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 3-(4-methoxyphenyl)-4-methyl-N-(3-nitrophenyl)-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O4S/c1-16-22(24(30)26-18-9-6-10-20(15-18)29(31)32)23(17-7-4-3-5-8-17)27-25(34)28(16)19-11-13-21(33-2)14-12-19/h3-15,23H,1-2H3,(H,26,30)(H,27,34)