1-[(E)-N-(diphenylphosphinothioylamino)-C-methyl-carbonimidoyl]-3-nitro-benzene

Systemtic Name: 1-[(E)-N-(diphenylphosphinothioylamino)-C-methyl-carbonimidoyl]-3-nitro-benzene Openeye Name: 1-[(E)-N-(diphenylphosphinothioylamino)-C-methyl-carbonimidoyl]-3-nitro-benzene CAS Name: 1-[(1E)-1-(diphenylphosphinothioylhydrazinylidene)ethyl]-3-nitrobenzene IUPAC Name: 1-[(E)-N-(diphenylphosphinothioylamino)-C-methylcarbonimidoyl]-3-nitrobenzene Traditional Name: diphenylthiophosphoryl-[(E)-1-(3-nitrophenyl)ethylideneamino]amine Formula: C20H18N3O2PS MolecularWeight: 395.414581

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNP(=S)(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NP(=S)(C1=CC=CC=C1)C2=CC=CC=C2)/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N3O2PS/c1-16(17-9-8-10-18(15-17)23(24)25)21-22-26(27,19-11-4-2-5-12-19)20-13-6-3-7-14-20/h2-15H,1H3,(H,22,27)/b21-16+