(4Z)-3-(4-nitrophenyl)-5-oxidanylidene-4-(phenylhydrazinylidene)pyrazole-1-carbothioamide

Systemtic Name: (4Z)-3-(4-nitrophenyl)-5-oxidanylidene-4-(phenylhydrazinylidene)pyrazole-1-carbothioamide Openeye Name: (4Z)-3-(4-nitrophenyl)-5-oxo-4-(phenylhydrazono)pyrazole-1-carbothioamide CAS Name: (4Z)-3-(4-nitrophenyl)-5-oxo-4-(phenylhydrazinylidene)-1-pyrazolecarbothioamide IUPAC Name: (4Z)-3-(4-nitrophenyl)-5-oxo-4-(phenylhydrazinylidene)pyrazole-1-carbothioamide Traditional Name: (4Z)-5-keto-3-(4-nitrophenyl)-4-(phenylhydrazono)-2-pyrazoline-1-carbothioamide Formula: C16H12N6O3S MolecularWeight: 368.36988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N/N=C\2/C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O3S/c17-16(26)21-15(23)14(19-18-11-4-2-1-3-5-11)13(20-21)10-6-8-12(9-7-10)22(24)25/h1-9,18H,(H2,17,26)/b19-14-