(4E)-5-isocyano-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)hydrazinylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-5-isocyano-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)hydrazinylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4E)-5-isocyano-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)hydrazono]-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-isocyano-4-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]hydrazinylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4E)-5-isocyano-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)hydrazinylidene]-2-phenylpyrazol-3-one Traditional Name: (4E)-5-isocyano-4-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]hydrazono]-2-phenyl-2-pyrazolin-3-one Formula: C13H9N7OS2 MolecularWeight: 343.38686

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(S1)NN=C2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-]

Isomeric SMILES

CSC1=NN=C(S1)N/N=C/2\C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-]

InChI

InChI=1S/C13H9N7OS2/c1-14-10-9(15-16-12-17-18-13(22-2)23-12)11(21)20(19-10)8-6-4-3-5-7-8/h3-7H,2H3,(H,16,17)/b15-9+