4-[(3-bromanyl-4-methyl-phenyl)hydrazinylidene]-2-(4-tert-butyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)pyrazol-3-one

Systemtic Name: 4-[(3-bromanyl-4-methyl-phenyl)hydrazinylidene]-2-(4-tert-butyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)pyrazol-3-one Openeye Name: 4-[(3-bromo-4-methyl-phenyl)hydrazono]-2-(4-tert-butylthiazol-2-yl)-5-(4-nitrophenyl)pyrazol-3-one CAS Name: 4-[(3-bromo-4-methylphenyl)hydrazinylidene]-2-(4-tert-butyl-2-thiazolyl)-5-(4-nitrophenyl)-3-pyrazolone IUPAC Name: 4-[(3-bromo-4-methylphenyl)hydrazinylidene]-2-(4-tert-butyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)pyrazol-3-one Traditional Name: 4-[(3-bromo-4-methyl-phenyl)hydrazono]-2-(4-tert-butylthiazol-2-yl)-5-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C23H21BrN6O3S MolecularWeight: 541.42024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NN=C2C(=NN(C2=O)C3=NC(=CS3)C(C)(C)C)C4=CC=C(C=C4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C=C1)NN=C2C(=NN(C2=O)C3=NC(=CS3)C(C)(C)C)C4=CC=C(C=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C23H21BrN6O3S/c1-13-5-8-15(11-17(13)24)26-27-20-19(14-6-9-16(10-7-14)30(32)33)28-29(21(20)31)22-25-18(12-34-22)23(2,3)4/h5-12,26H,1-4H3