4-[2-[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-(4-nitrophenyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzenesulfonamide

Systemtic Name: 4-[2-[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-(4-nitrophenyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzenesulfonamide Openeye Name: 4-[2-[1-(4-tert-butylthiazol-2-yl)-3-(4-nitrophenyl)-5-oxo-pyrazol-4-ylidene]hydrazino]benzenesulfonamide CAS Name: 4-[2-[1-(4-tert-butyl-2-thiazolyl)-3-(4-nitrophenyl)-5-oxo-4-pyrazolylidene]hydrazinyl]benzenesulfonamide IUPAC Name: 4-[2-[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-(4-nitrophenyl)-5-oxopyrazol-4-ylidene]hydrazinyl]benzenesulfonamide Traditional Name: 4-[N'-[1-(4-tert-butylthiazol-2-yl)-5-keto-3-(4-nitrophenyl)-2-pyrazolin-4-ylidene]hydrazino]benzenesulfonamide Formula: C22H21N7O5S2 MolecularWeight: 527.57604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)N2C(=O)C(=NNC3=CC=C(C=C3)S(=O)(=O)N)C(=N2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)N2C(=O)C(=NNC3=CC=C(C=C3)S(=O)(=O)N)C(=N2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N7O5S2/c1-22(2,3)17-12-35-21(24-17)28-20(30)19(18(27-28)13-4-8-15(9-5-13)29(31)32)26-25-14-6-10-16(11-7-14)36(23,33)34/h4-12,25H,1-3H3,(H2,23,33,34)