2-(4-tert-butyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)-4-(phenylhydrazinylidene)pyrazol-3-one

Systemtic Name: 2-(4-tert-butyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)-4-(phenylhydrazinylidene)pyrazol-3-one Openeye Name: 2-(4-tert-butylthiazol-2-yl)-5-(4-nitrophenyl)-4-(phenylhydrazono)pyrazol-3-one CAS Name: 2-(4-tert-butyl-2-thiazolyl)-5-(4-nitrophenyl)-4-(phenylhydrazinylidene)-3-pyrazolone IUPAC Name: 2-(4-tert-butyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)-4-(phenylhydrazinylidene)pyrazol-3-one Traditional Name: 2-(4-tert-butylthiazol-2-yl)-5-(4-nitrophenyl)-4-(phenylhydrazono)-2-pyrazolin-3-one Formula: C22H20N6O3S MolecularWeight: 448.4976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N6O3S/c1-22(2,3)17-13-32-21(23-17)27-20(29)19(25-24-15-7-5-4-6-8-15)18(26-27)14-9-11-16(12-10-14)28(30)31/h4-13,24H,1-3H3