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

Systemtic Name: (4E)-4-[(2-morpholin-4-ylcarbonylphenyl)hydrazinylidene]-5-oxidanylidene-3-phenyl-pyrazole-1-carbothioamide Openeye Name: (4E)-4-[[2-(morpholine-4-carbonyl)phenyl]hydrazono]-5-oxo-3-phenyl-pyrazole-1-carbothioamide CAS Name: (4E)-4-[[2-[4-morpholinyl(oxo)methyl]phenyl]hydrazinylidene]-5-oxo-3-phenyl-1-pyrazolecarbothioamide IUPAC Name: (4E)-4-[[2-(morpholine-4-carbonyl)phenyl]hydrazinylidene]-5-oxo-3-phenylpyrazole-1-carbothioamide Traditional Name: (4E)-5-keto-4-[[2-(morpholine-4-carbonyl)phenyl]hydrazono]-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C21H20N6O3S MolecularWeight: 436.4869

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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=CC=C4

Isomeric SMILES

C1COCCN1C(=O)C2=CC=CC=C2N/N=C/3\C(=NN(C3=O)C(=S)N)C4=CC=CC=C4

InChI

InChI=1S/C21H20N6O3S/c22-21(31)27-20(29)18(17(25-27)14-6-2-1-3-7-14)24-23-16-9-5-4-8-15(16)19(28)26-10-12-30-13-11-26/h1-9,23H,10-13H2,(H2,22,31)/b24-18+