4-[(2,5-dimethylphenyl)hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide

Systemtic Name: 4-[(2,5-dimethylphenyl)hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide Openeye Name: 4-[(2,5-dimethylphenyl)hydrazono]-5-oxo-3-phenyl-pyrazole-1-carbothioamide CAS Name: 4-[(2,5-dimethylphenyl)hydrazinylidene]-5-oxo-3-phenyl-1-pyrazolecarbothioamide IUPAC Name: 4-[(2,5-dimethylphenyl)hydrazinylidene]-5-oxo-3-phenylpyrazole-1-carbothioamide Traditional Name: 4-[(2,5-dimethylphenyl)hydrazono]-5-keto-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=CC=C3

InChI

InChI=1S/C18H17N5OS/c1-11-8-9-12(2)14(10-11)20-21-16-15(13-6-4-3-5-7-13)22-23(17(16)24)18(19)25/h3-10,20H,1-2H3,(H2,19,25)