[(E)-1-benzamido-2-(4-chlorophenyl)sulfanyl-ethenyl]-triphenyl-phosphanium chloride

Systemtic Name: [(E)-1-benzamido-2-(4-chlorophenyl)sulfanyl-ethenyl]-triphenyl-phosphanium chloride Openeye Name: [(E)-1-benzamido-2-(4-chlorophenyl)sulfanyl-vinyl]-triphenyl-phosphonium chloride CAS Name: [(E)-1-benzamido-2-[(4-chlorophenyl)thio]ethenyl]-triphenylphosphonium chloride IUPAC Name: [(E)-1-benzamido-2-(4-chlorophenyl)sulfanylethenyl]-triphenylphosphanium chloride Traditional Name: [(E)-1-benzamido-2-[(4-chlorophenyl)thio]vinyl]-triphenyl-phosphonium chloride Formula: C33H26Cl2NOPS MolecularWeight: 586.510401

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CSC2=CC=C(C=C2)Cl)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C\SC2=CC=C(C=C2)Cl)/[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C33H25ClNOPS.ClH/c34-27-21-23-31(24-22-27)38-25-32(35-33(36)26-13-5-1-6-14-26)37(28-15-7-2-8-16-28,29-17-9-3-10-18-29)30-19-11-4-12-20-30;/h1-25H;1H/b32-25+;