triphenyl-[2-phenyl-4,6-bis(phenylsulfanyl)pyrimidin-5-yl]phosphanium perchlorate

Systemtic Name: triphenyl-[2-phenyl-4,6-bis(phenylsulfanyl)pyrimidin-5-yl]phosphanium perchlorate Openeye Name: triphenyl-[2-phenyl-4,6-bis(phenylsulfanyl)pyrimidin-5-yl]phosphonium perchlorate CAS Name: triphenyl-[2-phenyl-4,6-bis(phenylthio)-5-pyrimidinyl]phosphonium perchlorate IUPAC Name: triphenyl-[2-phenyl-4,6-bis(phenylsulfanyl)pyrimidin-5-yl]phosphanium perchlorate Traditional Name: triphenyl-[2-phenyl-4,6-bis(phenylthio)pyrimidin-5-yl]phosphonium perchlorate Formula: C40H30ClN2O4PS2 MolecularWeight: 733.233961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=N2)SC3=CC=CC=C3)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)SC7=CC=CC=C7.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=N2)SC3=CC=CC=C3)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)SC7=CC=CC=C7.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C40H30N2PS2.ClHO4/c1-7-19-31(20-8-1)38-41-39(44-35-27-15-5-16-28-35)37(40(42-38)45-36-29-17-6-18-30-36)43(32-21-9-2-10-22-32,33-23-11-3-12-24-33)34-25-13-4-14-26-34;2-1(3,4)5/h1-30H;(H,2,3,4,5)/q+1;/p-1