3-ethyl-N'-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-ethyl-N'-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-ethyl-N'-(2-methylsulfanyl-3-phenyl-imidazole-4-carbonyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-ethyl-N'-[[2-(methylthio)-3-phenyl-4-imidazolyl]-oxomethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-ethyl-N'-(2-methylsulfanyl-3-phenylimidazole-4-carbonyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-ethyl-4-keto-N'-[2-(methylthio)-3-phenyl-imidazole-4-carbonyl]phthalazine-1-carbohydrazide Formula: C22H20N6O3S MolecularWeight: 448.4976

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CN=C(N3C4=CC=CC=C4)SC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CN=C(N3C4=CC=CC=C4)SC

InChI

InChI=1S/C22H20N6O3S/c1-3-27-21(31)16-12-8-7-11-15(16)18(26-27)20(30)25-24-19(29)17-13-23-22(32-2)28(17)14-9-5-4-6-10-14/h4-13H,3H2,1-2H3,(H,24,29)(H,25,30)