N-[2-cyano-2-(triphenyl-$l^{5}-phosphanylidene)ethanethioyl]-2-methyl-benzamide

Systemtic Name: N-[2-cyano-2-(triphenyl-$l^{5}-phosphanylidene)ethanethioyl]-2-methyl-benzamide Openeye Name: N-[2-cyano-2-(triphenyl-$l^{5}-phosphanylidene)ethanethioyl]-2-methyl-benzamide CAS Name: N-(2-cyano-1-sulfanylidene-2-triphenylphosphoranylideneethyl)-2-methylbenzamide IUPAC Name: N-[2-cyano-2-(triphenyl-$l^{5}-phosphanylidene)ethanethioyl]-2-methylbenzamide Traditional Name: N-(2-cyano-2-triphenylphosphoranylidene-thioacetyl)-2-methyl-benzamide Formula: C29H23N2OPS MolecularWeight: 478.544481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=S)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=S)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H23N2OPS/c1-22-13-11-12-20-26(22)28(32)31-29(34)27(21-30)33(23-14-5-2-6-15-23,24-16-7-3-8-17-24)25-18-9-4-10-19-25/h2-20H,1H3,(H,31,32,34)