3-(4-nitrophenyl)-5-oxidanylidene-4-(1,3-thiazol-2-ylhydrazinylidene)pyrazole-1-carbothioamide

Systemtic Name: 3-(4-nitrophenyl)-5-oxidanylidene-4-(1,3-thiazol-2-ylhydrazinylidene)pyrazole-1-carbothioamide Openeye Name: 3-(4-nitrophenyl)-5-oxo-4-(thiazol-2-ylhydrazono)pyrazole-1-carbothioamide CAS Name: 3-(4-nitrophenyl)-5-oxo-4-(2-thiazolylhydrazinylidene)-1-pyrazolecarbothioamide IUPAC Name: 3-(4-nitrophenyl)-5-oxo-4-(1,3-thiazol-2-ylhydrazinylidene)pyrazole-1-carbothioamide Traditional Name: 5-keto-3-(4-nitrophenyl)-4-(thiazol-2-ylhydrazono)-2-pyrazoline-1-carbothioamide Formula: C13H9N7O3S2 MolecularWeight: 375.38566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)C2=NNC3=NC=CS3)C(=S)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)C2=NNC3=NC=CS3)C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C13H9N7O3S2/c14-12(24)19-11(21)10(16-17-13-15-5-6-25-13)9(18-19)7-1-3-8(4-2-7)20(22)23/h1-6H,(H2,14,24)(H,15,17)