(4E)-3-methyl-4-[(3-nitrophenyl)hydrazinylidene]-5-oxidanylidene-pyrazole-1-carbothioamide

Systemtic Name: (4E)-3-methyl-4-[(3-nitrophenyl)hydrazinylidene]-5-oxidanylidene-pyrazole-1-carbothioamide Openeye Name: (4E)-3-methyl-4-[(3-nitrophenyl)hydrazono]-5-oxo-pyrazole-1-carbothioamide CAS Name: (4E)-3-methyl-4-[(3-nitrophenyl)hydrazinylidene]-5-oxo-1-pyrazolecarbothioamide IUPAC Name: (4E)-3-methyl-4-[(3-nitrophenyl)hydrazinylidene]-5-oxopyrazole-1-carbothioamide Traditional Name: (4E)-5-keto-3-methyl-4-[(3-nitrophenyl)hydrazono]-2-pyrazoline-1-carbothioamide Formula: C11H10N6O3S MolecularWeight: 306.3005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC(=CC=C2)[N+](=O)[O-])C(=S)N

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=CC(=CC=C2)[N+](=O)[O-])C(=S)N

InChI

InChI=1S/C11H10N6O3S/c1-6-9(10(18)16(15-6)11(12)21)14-13-7-3-2-4-8(5-7)17(19)20/h2-5,13H,1H3,(H2,12,21)/b14-9+