(Z)-2-benzamido-1-[(4-methylphenyl)amino]-3-sulfanylidene-3-triphenylphosphaniumyl-prop-1-en-1-olate

Systemtic Name: (Z)-2-benzamido-1-[(4-methylphenyl)amino]-3-sulfanylidene-3-triphenylphosphaniumyl-prop-1-en-1-olate Openeye Name: (Z)-2-benzamido-1-(4-methylanilino)-3-thioxo-3-triphenylphosphaniumyl-prop-1-en-1-olate CAS Name: (Z)-2-benzamido-1-(4-methylanilino)-3-sulfanylidene-3-triphenylphosphiniumyl-1-propen-1-olate IUPAC Name: (Z)-2-benzamido-1-(4-methylanilino)-3-sulfanylidene-3-triphenylphosphaniumylprop-1-en-1-olate Traditional Name: (Z)-2-benzamido-1-(p-toluidino)-3-thioxo-3-triphenylphosphiniumyl-prop-1-en-1-olate Formula: C35H29N2O2PS MolecularWeight: 572.655721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=C(C(=S)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=C(\C(=S)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/NC(=O)C5=CC=CC=C5)/[O-]

InChI

InChI=1S/C35H29N2O2PS/c1-26-22-24-28(25-23-26)36-34(39)32(37-33(38)27-14-6-2-7-15-27)35(41)40(29-16-8-3-9-17-29,30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-25H,1H3,(H2-,36,37,38,39,41)