4-[(2-morpholin-4-ylcarbonylphenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxidanylidene-pyrazole-1-carbothioamide

Systemtic Name: 4-[(2-morpholin-4-ylcarbonylphenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxidanylidene-pyrazole-1-carbothioamide Openeye Name: 4-[[2-(morpholine-4-carbonyl)phenyl]hydrazono]-3-(4-nitrophenyl)-5-oxo-pyrazole-1-carbothioamide CAS Name: 4-[[2-[4-morpholinyl(oxo)methyl]phenyl]hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-1-pyrazolecarbothioamide IUPAC Name: 4-[[2-(morpholine-4-carbonyl)phenyl]hydrazinylidene]-3-(4-nitrophenyl)-5-oxopyrazole-1-carbothioamide Traditional Name: 5-keto-4-[[2-(morpholine-4-carbonyl)phenyl]hydrazono]-3-(4-nitrophenyl)-2-pyrazoline-1-carbothioamide Formula: C21H19N7O5S MolecularWeight: 481.48446

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC=CC=C2NN=C3C(=NN(C3=O)C(=S)N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C2=CC=CC=C2NN=C3C(=NN(C3=O)C(=S)N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N7O5S/c22-21(34)27-20(30)18(17(25-27)13-5-7-14(8-6-13)28(31)32)24-23-16-4-2-1-3-15(16)19(29)26-9-11-33-12-10-26/h1-8,23H,9-12H2,(H2,22,34)