N-[4-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[oxo-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]carbamoyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]phenyl]-2-furamide Formula: C26H25N5O5 MolecularWeight: 487.5072

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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=CO4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H25N5O5/c1-2-3-6-15-31-26(35)20-9-5-4-8-19(20)22(30-31)25(34)29-28-23(32)17-11-13-18(14-12-17)27-24(33)21-10-7-16-36-21/h4-5,7-14,16H,2-3,6,15H2,1H3,(H,27,33)(H,28,32)(H,29,34)