3-nitro-N-[4-[(2-phenylethanoylamino)carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[4-[(2-phenylethanoylamino)carbamoyl]phenyl]benzenesulfonamide Openeye Name: 3-nitro-N-[4-[[(2-phenylacetyl)amino]carbamoyl]phenyl]benzenesulfonamide CAS Name: 3-nitro-N-[4-[oxo-[(1-oxo-2-phenylethyl)hydrazo]methyl]phenyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[4-[[(2-phenylacetyl)amino]carbamoyl]phenyl]benzenesulfonamide Traditional Name: 3-nitro-N-[4-[[(2-phenylacetyl)amino]carbamoyl]phenyl]benzenesulfonamide Formula: C21H18N4O6S MolecularWeight: 454.45582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O6S/c26-20(13-15-5-2-1-3-6-15)22-23-21(27)16-9-11-17(12-10-16)24-32(30,31)19-8-4-7-18(14-19)25(28)29/h1-12,14,24H,13H2,(H,22,26)(H,23,27)