4-nitro-N-[3-[phenyl-[(phenylmethyl)amino]phosphinothioyl]oxypropyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[3-[phenyl-[(phenylmethyl)amino]phosphinothioyl]oxypropyl]benzenesulfonamide Openeye Name: N-[3-[(benzylamino)-phenyl-phosphinothioyl]oxypropyl]-4-nitro-benzenesulfonamide CAS Name: 4-nitro-N-[3-[phenyl-[(phenylmethyl)amino]phosphinothioyl]oxypropyl]benzenesulfonamide IUPAC Name: N-[3-[(benzylamino)-phenylphosphinothioyl]oxypropyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-[(benzylamino)-phenyl-thiophosphoryl]oxypropyl]-4-nitro-benzenesulfonamide Formula: C22H24N3O5PS2 MolecularWeight: 505.546821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNP(=S)(C2=CC=CC=C2)OCCCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNP(=S)(C2=CC=CC=C2)OCCCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N3O5PS2/c26-25(27)20-12-14-22(15-13-20)33(28,29)24-16-7-17-30-31(32,21-10-5-2-6-11-21)23-18-19-8-3-1-4-9-19/h1-6,8-15,24H,7,16-18H2,(H,23,32)