4-[(1,3-diphenylpyrazol-4-yl)methylamino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(1,3-diphenylpyrazol-4-yl)methylamino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(1,3-diphenylpyrazol-4-yl)methylamino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[(1,3-diphenyl-4-pyrazolyl)methylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(1,3-diphenylpyrazol-4-yl)methylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(1,3-diphenylpyrazol-4-yl)methylamino]-N-methyl-3-nitro-benzenesulfonamide Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O4S/c1-24-33(31,32)20-12-13-21(22(14-20)28(29)30)25-15-18-16-27(19-10-6-3-7-11-19)26-23(18)17-8-4-2-5-9-17/h2-14,16,24-25H,15H2,1H3