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

Systemtic Name: N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-(prop-2-enylamino)pentanamide Openeye Name: 5-(allylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide CAS Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(prop-2-enylamino)pentanamide IUPAC Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(prop-2-enylamino)pentanamide Traditional Name: 5-(allylamino)-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]valeramide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O2/c1-2-13-23-14-6-5-12-20(27)24-17-9-7-8-16(15-17)21-18-10-3-4-11-19(18)22(28)26-25-21/h2-4,7-11,15,23H,1,5-6,12-14H2,(H,24,27)(H,26,28)