N'-(3-cyanophenyl)carbonyl-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(3-cyanophenyl)carbonyl-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(3-cyanobenzoyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[(3-cyanophenyl)-oxomethyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(3-cyanobenzoyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-(3-cyanobenzoyl)-4-keto-phthalazine-1-carbohydrazide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H21N5O3/c1-2-3-6-12-27-22(30)18-11-5-4-10-17(18)19(26-27)21(29)25-24-20(28)16-9-7-8-15(13-16)14-23/h4-5,7-11,13H,2-3,6,12H2,1H3,(H,24,28)(H,25,29)