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

Systemtic Name: 6-(4-chloranyl-3-nitro-phenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 6-(4-chloro-3-nitro-phenyl)-3,4-dimethyl-N-(p-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 6-(4-chloro-3-nitrophenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 6-(4-chloro-3-nitrophenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 6-(4-chloro-3-nitro-phenyl)-3,4-dimethyl-N-(p-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C20H19ClN4O3S MolecularWeight: 430.90786

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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)Cl)[N+](=O)[O-])C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN4O3S/c1-11-4-7-14(8-5-11)22-19(26)17-12(2)24(3)20(29)23-18(17)13-6-9-15(21)16(10-13)25(27)28/h4-10,18H,1-3H3,(H,22,26)(H,23,29)