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

Systemtic Name: 5-(butan-2-ylamino)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]pentanamide Openeye Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(sec-butylamino)pentanamide CAS Name: 5-(butan-2-ylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide IUPAC Name: 5-(butan-2-ylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide Traditional Name: N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]-5-(sec-butylamino)valeramide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2/c1-3-16(2)24-14-7-6-13-21(28)25-18-10-8-9-17(15-18)22-19-11-4-5-12-20(19)23(29)27-26-22/h4-5,8-12,15-16,24H,3,6-7,13-14H2,1-2H3,(H,25,28)(H,27,29)