2-(benzotriazol-1-yl)-1-(2-methylsulfanylphenyl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-(2-methylsulfanylphenyl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-(2-methylsulfanylphenyl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanone CAS Name: 2-(1-benzotriazolyl)-1-[2-(methylthio)phenyl]-2-triphenylphosphoranylideneethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-(2-methylsulfanylphenyl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[2-(methylthio)phenyl]-2-triphenylphosphoranylidene-ethanone Formula: C33H26N3OPS MolecularWeight: 543.617801

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5C6=CC=CC=C6N=N5

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C33H26N3OPS/c1-39-31-24-14-11-21-28(31)32(37)33(36-30-23-13-12-22-29(30)34-35-36)38(25-15-5-2-6-16-25,26-17-7-3-8-18-26)27-19-9-4-10-20-27/h2-24H,1H3