[1-[(4-chlorophenyl)carbonylamino]-2-propylsulfanyl-ethenyl]-triphenyl-phosphanium iodide

Systemtic Name: [1-[(4-chlorophenyl)carbonylamino]-2-propylsulfanyl-ethenyl]-triphenyl-phosphanium iodide Openeye Name: [1-[(4-chlorobenzoyl)amino]-2-propylsulfanyl-vinyl]-triphenyl-phosphonium iodide CAS Name: [1-[[(4-chlorophenyl)-oxomethyl]amino]-2-(propylthio)ethenyl]-triphenylphosphonium iodide IUPAC Name: [1-[(4-chlorobenzoyl)amino]-2-propylsulfanylethenyl]-triphenylphosphanium iodide Traditional Name: [1-[(4-chlorobenzoyl)amino]-2-(propylthio)vinyl]-triphenyl-phosphonium iodide Formula: C30H28ClINOPS MolecularWeight: 643.945651

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC=C(NC(=O)C1=CC=C(C=C1)Cl)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

CCCSC=C(NC(=O)C1=CC=C(C=C1)Cl)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C30H27ClNOPS.HI/c1-2-22-35-23-29(32-30(33)24-18-20-25(31)21-19-24)34(26-12-6-3-7-13-26,27-14-8-4-9-15-27)28-16-10-5-11-17-28;/h3-21,23H,2,22H2,1H3;1H