3-nitro-N-phenyl-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzenesulfonamide

Systemtic Name: 3-nitro-N-phenyl-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzenesulfonamide Openeye Name: 3-nitro-N-phenyl-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzenesulfonamide CAS Name: 3-nitro-N-phenyl-4-[2-(1-phenyl-4-pyrazolyl)ethylamino]benzenesulfonamide IUPAC Name: 3-nitro-N-phenyl-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzenesulfonamide Traditional Name: 3-nitro-N-phenyl-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzenesulfonamide Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O4S/c29-28(30)23-15-21(33(31,32)26-19-7-3-1-4-8-19)11-12-22(23)24-14-13-18-16-25-27(17-18)20-9-5-2-6-10-20/h1-12,15-17,24,26H,13-14H2