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

Systemtic Name: N-[4-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]phenyl]benzamide Openeye Name: N-[4-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]phenyl]benzamide CAS Name: N-[4-[oxo-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: N-[4-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]carbamoyl]phenyl]benzamide Traditional Name: N-[4-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]phenyl]benzamide Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H27N5O4/c1-2-3-9-18-33-28(37)23-13-8-7-12-22(23)24(32-33)27(36)31-30-26(35)20-14-16-21(17-15-20)29-25(34)19-10-5-4-6-11-19/h4-8,10-17H,2-3,9,18H2,1H3,(H,29,34)(H,30,35)(H,31,36)