(4E)-4-[(4-chloranyl-3-nitro-phenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxidanylidene-pyrazole-1-carbothioamide

Systemtic Name: (4E)-4-[(4-chloranyl-3-nitro-phenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxidanylidene-pyrazole-1-carbothioamide Openeye Name: (4E)-4-[(4-chloro-3-nitro-phenyl)hydrazono]-3-(4-nitrophenyl)-5-oxo-pyrazole-1-carbothioamide CAS Name: (4E)-4-[(4-chloro-3-nitrophenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-1-pyrazolecarbothioamide IUPAC Name: (4E)-4-[(4-chloro-3-nitrophenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxopyrazole-1-carbothioamide Traditional Name: (4E)-4-[(4-chloro-3-nitro-phenyl)hydrazono]-5-keto-3-(4-nitrophenyl)-2-pyrazoline-1-carbothioamide Formula: C16H10ClN7O5S MolecularWeight: 447.8125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)C2=NNC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=S)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C\2=NN(C(=O)/C2=N/NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClN7O5S/c17-11-6-3-9(7-12(11)24(28)29)19-20-14-13(21-22(15(14)25)16(18)30)8-1-4-10(5-2-8)23(26)27/h1-7,19H,(H2,18,30)/b20-14+