(3-methylsulfanyl-1-phenyl-pyrimido[1,6-a]benzimidazol-4-yl)-triphenyl-phosphanium

Systemtic Name: (3-methylsulfanyl-1-phenyl-pyrimido[1,6-a]benzimidazol-4-yl)-triphenyl-phosphanium Openeye Name: (3-methylsulfanyl-1-phenyl-pyrimido[1,6-a]benzimidazol-4-yl)-triphenyl-phosphonium CAS Name: [3-(methylthio)-1-phenyl-4-pyrimido[1,6-a]benzimidazolyl]-triphenylphosphonium IUPAC Name: (3-methylsulfanyl-1-phenylpyrimido[1,6-a]benzimidazol-4-yl)-triphenylphosphanium Traditional Name: [3-(methylthio)-1-phenyl-pyrimido[1,6-a]benzimidazol-4-yl]-triphenyl-phosphonium Formula: C35H27N3PS+ MolecularWeight: 552.647741

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C2=NC3=CC=CC=C3N2C(=N1)C4=CC=CC=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CSC1=C(C2=NC3=CC=CC=C3N2C(=N1)C4=CC=CC=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C35H27N3PS/c1-40-35-32(34-36-30-24-14-15-25-31(30)38(34)33(37-35)26-16-6-2-7-17-26)39(27-18-8-3-9-19-27,28-20-10-4-11-21-28)29-22-12-5-13-23-29/h2-25H,1H3/q+1