N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzenesulfonamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzenesulfonamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-[(1-ethyl-4-pyrazolyl)amino]-3-nitrobenzenesulfonamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-[(1-ethylpyrazol-4-yl)amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(1-ethylpyrazol-4-yl)amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-nitro-benzenesulfonamide Formula: C22H23N7O5S MolecularWeight: 497.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NC2=C(C=C(C=C2)S(=O)(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C=N1)NC2=C(C=C(C=C2)S(=O)(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H23N7O5S/c1-4-27-14-16(13-23-27)24-19-11-10-18(12-20(19)29(31)32)35(33,34)25-21-15(2)26(3)28(22(21)30)17-8-6-5-7-9-17/h5-14,24-25H,4H2,1-3H3