4-[(2-methyl-3-nitro-phenyl)hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide

Systemtic Name: 4-[(2-methyl-3-nitro-phenyl)hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide Openeye Name: 4-[(2-methyl-3-nitro-phenyl)hydrazono]-5-oxo-3-phenyl-pyrazole-1-carbothioamide CAS Name: 4-[(2-methyl-3-nitrophenyl)hydrazinylidene]-5-oxo-3-phenyl-1-pyrazolecarbothioamide IUPAC Name: 4-[(2-methyl-3-nitrophenyl)hydrazinylidene]-5-oxo-3-phenylpyrazole-1-carbothioamide Traditional Name: 5-keto-4-[(2-methyl-3-nitro-phenyl)hydrazono]-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C17H14N6O3S MolecularWeight: 382.39646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NN=C2C(=NN(C2=O)C(=S)N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NN=C2C(=NN(C2=O)C(=S)N)C3=CC=CC=C3

InChI

InChI=1S/C17H14N6O3S/c1-10-12(8-5-9-13(10)23(25)26)19-20-15-14(11-6-3-2-4-7-11)21-22(16(15)24)17(18)27/h2-9,19H,1H3,(H2,18,27)