N'-(3-methylbutanoyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide

Systemtic Name: N'-(3-methylbutanoyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide Openeye Name: 3-benzyl-N'-(3-methylbutanoyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-(3-methyl-1-oxobutyl)-4-oxo-3-(phenylmethyl)-1-phthalazinecarbohydrazide IUPAC Name: 3-benzyl-N'-(3-methylbutanoyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-benzyl-N'-isovaleryl-4-keto-phthalazine-1-carbohydrazide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3/c1-14(2)12-18(26)22-23-20(27)19-16-10-6-7-11-17(16)21(28)25(24-19)13-15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3,(H,22,26)(H,23,27)