[(E)-1-benzamido-3,3-bis[(4-chlorophenyl)sulfanyl]prop-1-enyl]-triphenyl-phosphanium

Systemtic Name: [(E)-1-benzamido-3,3-bis[(4-chlorophenyl)sulfanyl]prop-1-enyl]-triphenyl-phosphanium Openeye Name: [(E)-1-benzamido-3,3-bis[(4-chlorophenyl)sulfanyl]prop-1-enyl]-triphenyl-phosphonium CAS Name: [(E)-1-benzamido-3,3-bis[(4-chlorophenyl)thio]prop-1-enyl]-triphenylphosphonium IUPAC Name: [(E)-1-benzamido-3,3-bis[(4-chlorophenyl)sulfanyl]prop-1-enyl]-triphenylphosphanium Traditional Name: [(E)-1-benzamido-3,3-bis[(4-chlorophenyl)thio]prop-1-enyl]-triphenyl-phosphonium Formula: C40H31Cl2NOPS2+ MolecularWeight: 707.690001

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC(SC2=CC=C(C=C2)Cl)SC3=CC=C(C=C3)Cl)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C\C(SC2=CC=C(C=C2)Cl)SC3=CC=C(C=C3)Cl)/[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C40H30Cl2NOPS2/c41-31-21-25-36(26-22-31)46-39(47-37-27-23-32(42)24-28-37)29-38(43-40(44)30-13-5-1-6-14-30)45(33-15-7-2-8-16-33,34-17-9-3-10-18-34)35-19-11-4-12-20-35/h1-29,39H/p+1/b38-29+