3-(4-nitrophenyl)-5-oxidanylidene-4-[(4-phenyldiazenylphenyl)hydrazinylidene]pyrazole-1-carbothioamide

Systemtic Name: 3-(4-nitrophenyl)-5-oxidanylidene-4-[(4-phenyldiazenylphenyl)hydrazinylidene]pyrazole-1-carbothioamide Openeye Name: 3-(4-nitrophenyl)-5-oxo-4-[(4-phenylazophenyl)hydrazono]pyrazole-1-carbothioamide CAS Name: 3-(4-nitrophenyl)-5-oxo-4-[(4-phenyldiazenylphenyl)hydrazinylidene]-1-pyrazolecarbothioamide IUPAC Name: 3-(4-nitrophenyl)-5-oxo-4-[(4-phenyldiazenylphenyl)hydrazinylidene]pyrazole-1-carbothioamide Traditional Name: 5-keto-3-(4-nitrophenyl)-4-[(4-phenylazophenyl)hydrazono]-2-pyrazoline-1-carbothioamide Formula: C22H16N8O3S MolecularWeight: 472.47924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NN=C3C(=NN(C3=O)C(=S)N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NN=C3C(=NN(C3=O)C(=S)N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N8O3S/c23-22(34)29-21(31)20(19(28-29)14-6-12-18(13-7-14)30(32)33)27-26-17-10-8-16(9-11-17)25-24-15-4-2-1-3-5-15/h1-13,26H,(H2,23,34)