N'-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-[2-(3,5-dimethylisoxazol-4-yl)acetyl]-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[2-(3,5-dimethyl-4-isoxazolyl)-1-oxoethyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-[2-(3,5-dimethylisoxazol-4-yl)acetyl]-4-keto-phthalazine-1-carbohydrazide Formula: C21H25N5O4 MolecularWeight: 411.4543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CC3=C(ON=C3C)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CC3=C(ON=C3C)C

InChI

InChI=1S/C21H25N5O4/c1-4-5-8-11-26-21(29)16-10-7-6-9-15(16)19(24-26)20(28)23-22-18(27)12-17-13(2)25-30-14(17)3/h6-7,9-10H,4-5,8,11-12H2,1-3H3,(H,22,27)(H,23,28)