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

Systemtic Name: N-ethyl-4-[(E)-3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenesulfonamide Openeye Name: N-ethyl-4-[(E)-3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]benzenesulfonamide CAS Name: N-ethyl-4-[(E)-3-[4-(2-nitrophenyl)-1-piperazinyl]-3-oxoprop-1-enyl]benzenesulfonamide IUPAC Name: N-ethyl-4-[(E)-3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxoprop-1-enyl]benzenesulfonamide Traditional Name: N-ethyl-4-[(E)-3-keto-3-[4-(2-nitrophenyl)piperazino]prop-1-enyl]benzenesulfonamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5S/c1-2-22-31(29,30)18-10-7-17(8-11-18)9-12-21(26)24-15-13-23(14-16-24)19-5-3-4-6-20(19)25(27)28/h3-12,22H,2,13-16H2,1H3/b12-9+