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

Systemtic Name: (4E)-4-[(2-cyanophenyl)hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide Openeye Name: (4E)-4-[(2-cyanophenyl)hydrazono]-5-oxo-3-phenyl-pyrazole-1-carbothioamide CAS Name: (4E)-4-[(2-cyanophenyl)hydrazinylidene]-5-oxo-3-phenyl-1-pyrazolecarbothioamide IUPAC Name: (4E)-4-[(2-cyanophenyl)hydrazinylidene]-5-oxo-3-phenylpyrazole-1-carbothioamide Traditional Name: (4E)-4-[(2-cyanophenyl)hydrazono]-5-keto-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C17H12N6OS MolecularWeight: 348.38178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC=CC=C3C#N)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C\2=NN(C(=O)/C2=N/NC3=CC=CC=C3C#N)C(=S)N

InChI

InChI=1S/C17H12N6OS/c18-10-12-8-4-5-9-13(12)20-21-15-14(11-6-2-1-3-7-11)22-23(16(15)24)17(19)25/h1-9,20H,(H2,19,25)/b21-15+