1-(4-nitrophenyl)-5-phenyl-pyrimidine-4-thione

Systemtic Name: 1-(4-nitrophenyl)-5-phenyl-pyrimidine-4-thione Openeye Name: 1-(4-nitrophenyl)-5-phenyl-pyrimidine-4-thione CAS Name: 1-(4-nitrophenyl)-5-phenyl-4-pyrimidinethione IUPAC Name: 1-(4-nitrophenyl)-5-phenylpyrimidine-4-thione Traditional Name: 1-(4-nitrophenyl)-5-phenyl-pyrimidine-4-thione Formula: C16H11N3O2S MolecularWeight: 309.34244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C=NC2=S)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C=NC2=S)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O2S/c20-19(21)14-8-6-13(7-9-14)18-10-15(16(22)17-11-18)12-4-2-1-3-5-12/h1-11H