(4E)-3-methyl-5-oxidanylidene-4-[(5-phenyl-1H-pyrazol-3-yl)hydrazinylidene]pyrazole-1-carbothioamide

Systemtic Name: (4E)-3-methyl-5-oxidanylidene-4-[(5-phenyl-1H-pyrazol-3-yl)hydrazinylidene]pyrazole-1-carbothioamide Openeye Name: (4E)-3-methyl-5-oxo-4-[(5-phenyl-1H-pyrazol-3-yl)hydrazono]pyrazole-1-carbothioamide CAS Name: (4E)-3-methyl-5-oxo-4-[(5-phenyl-1H-pyrazol-3-yl)hydrazinylidene]-1-pyrazolecarbothioamide IUPAC Name: (4E)-3-methyl-5-oxo-4-[(5-phenyl-1H-pyrazol-3-yl)hydrazinylidene]pyrazole-1-carbothioamide Traditional Name: (4E)-5-keto-3-methyl-4-[(5-phenyl-1H-pyrazol-3-yl)hydrazono]-2-pyrazoline-1-carbothioamide Formula: C14H13N7OS MolecularWeight: 327.36432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=NNC(=C2)C3=CC=CC=C3)C(=S)N

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=NNC(=C2)C3=CC=CC=C3)C(=S)N

InChI

InChI=1S/C14H13N7OS/c1-8-12(13(22)21(20-8)14(15)23)19-18-11-7-10(16-17-11)9-5-3-2-4-6-9/h2-7H,1H3,(H2,15,23)(H2,16,17,18)/b19-12+