3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]benzamide

Systemtic Name: 3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]benzamide Openeye Name: 3-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]benzamide CAS Name: 3-[oxo-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]methyl]benzamide IUPAC Name: 3-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]carbamoyl]benzamide Traditional Name: 3-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]benzamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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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(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O4/c1-2-3-6-12-27-22(31)17-11-5-4-10-16(17)18(26-27)21(30)25-24-20(29)15-9-7-8-14(13-15)19(23)28/h4-5,7-11,13H,2-3,6,12H2,1H3,(H2,23,28)(H,24,29)(H,25,30)