[4-(1H-benzimidazol-2-ylsulfanyl)-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl]-triphenyl-phosphanium

Systemtic Name: [4-(1H-benzimidazol-2-ylsulfanyl)-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl]-triphenyl-phosphanium Openeye Name: [4-(1H-benzimidazol-2-ylsulfanyl)-6-oxo-2-phenyl-1H-pyrimidin-5-yl]-triphenyl-phosphonium CAS Name: [4-(1H-benzimidazol-2-ylthio)-6-oxo-2-phenyl-1H-pyrimidin-5-yl]-triphenylphosphonium IUPAC Name: [4-(1H-benzimidazol-2-ylsulfanyl)-6-oxo-2-phenyl-1H-pyrimidin-5-yl]-triphenylphosphanium Traditional Name: [4-(1H-benzimidazol-2-ylthio)-6-keto-2-phenyl-1H-pyrimidin-5-yl]-triphenyl-phosphonium Formula: C35H26N4OPS+ MolecularWeight: 581.645901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=O)N2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)SC6=NC7=CC=CC=C7N6

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=O)N2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)SC6=NC7=CC=CC=C7N6

InChI

InChI=1S/C35H25N4OPS/c40-33-31(41(26-17-7-2-8-18-26,27-19-9-3-10-20-27)28-21-11-4-12-22-28)34(39-32(38-33)25-15-5-1-6-16-25)42-35-36-29-23-13-14-24-30(29)37-35/h1-24H,(H-,36,37,38,39,40)/p+1