N-(3-nitrophenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide

Systemtic Name: N-(3-nitrophenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-N-(3-nitrophenyl)benzenesulfonamide CAS Name: N-(3-nitrophenyl)-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(3-nitrophenyl)benzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-keto-ethyl]-N-(3-nitrophenyl)benzenesulfonamide Formula: C25H26N4O5S MolecularWeight: 494.56274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O5S/c30-25(27-16-14-26(15-17-27)19-21-8-3-1-4-9-21)20-28(22-10-7-11-23(18-22)29(31)32)35(33,34)24-12-5-2-6-13-24/h1-13,18H,14-17,19-20H2