N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-(propan-2-ylamino)pentanamide

Systemtic Name: N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-(propan-2-ylamino)pentanamide Openeye Name: 5-(isopropylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide CAS Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(propan-2-ylamino)pentanamide IUPAC Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(propan-2-ylamino)pentanamide Traditional Name: 5-(isopropylamino)-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]valeramide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCCC(=O)NC1=CC=CC(=C1)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)NCCCCC(=O)NC1=CC=CC(=C1)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C22H26N4O2/c1-15(2)23-13-6-5-12-20(27)24-17-9-7-8-16(14-17)21-18-10-3-4-11-19(18)22(28)26-25-21/h3-4,7-11,14-15,23H,5-6,12-13H2,1-2H3,(H,24,27)(H,26,28)