(4E)-4-[[4-chloranyl-2-(phenylcarbonyl)phenyl]hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide

Systemtic Name: (4E)-4-[[4-chloranyl-2-(phenylcarbonyl)phenyl]hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide Openeye Name: (4E)-4-[(2-benzoyl-4-chloro-phenyl)hydrazono]-5-oxo-3-phenyl-pyrazole-1-carbothioamide CAS Name: (4E)-4-[(2-benzoyl-4-chlorophenyl)hydrazinylidene]-5-oxo-3-phenyl-1-pyrazolecarbothioamide IUPAC Name: (4E)-4-[(2-benzoyl-4-chlorophenyl)hydrazinylidene]-5-oxo-3-phenylpyrazole-1-carbothioamide Traditional Name: (4E)-4-[(2-benzoyl-4-chloro-phenyl)hydrazono]-5-keto-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C23H16ClN5O2S MolecularWeight: 461.92344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C\2=NN(C(=O)/C2=N/NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C(=S)N

InChI

InChI=1S/C23H16ClN5O2S/c24-16-11-12-18(17(13-16)21(30)15-9-5-2-6-10-15)26-27-20-19(14-7-3-1-4-8-14)28-29(22(20)31)23(25)32/h1-13,26H,(H2,25,32)/b27-20+