4-(4-chlorophenyl)-1,3-dimethyl-N,6-diphenyl-2-sulfanylidene-4H-pyrimidine-5-carboxamide

Systemtic Name: 4-(4-chlorophenyl)-1,3-dimethyl-N,6-diphenyl-2-sulfanylidene-4H-pyrimidine-5-carboxamide Openeye Name: 4-(4-chlorophenyl)-1,3-dimethyl-N,6-diphenyl-2-thioxo-4H-pyrimidine-5-carboxamide CAS Name: 4-(4-chlorophenyl)-1,3-dimethyl-N,6-diphenyl-2-sulfanylidene-4H-pyrimidine-5-carboxamide IUPAC Name: 4-(4-chlorophenyl)-1,3-dimethyl-N,6-diphenyl-2-sulfanylidene-4H-pyrimidine-5-carboxamide Traditional Name: 4-(4-chlorophenyl)-1,3-dimethyl-N,6-diphenyl-2-thioxo-4H-pyrimidine-5-carboxamide Formula: C25H22ClN3OS MolecularWeight: 447.97968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(=C(N(C1=S)C)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(C(=C(N(C1=S)C)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN3OS/c1-28-22(17-9-5-3-6-10-17)21(24(30)27-20-11-7-4-8-12-20)23(29(2)25(28)31)18-13-15-19(26)16-14-18/h3-16,23H,1-2H3,(H,27,30)