N-butyl-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide

Systemtic Name: N-butyl-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-butyl-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-butyl-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-butyl-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-butyl-2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3

Isomeric SMILES

CCCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3

InChI

InChI=1S/C20H22N4O2/c1-2-3-10-22-19(25)14-24-20(26)17-7-5-4-6-16(17)18(23-24)13-15-8-11-21-12-9-15/h4-9,11-12H,2-3,10,13-14H2,1H3,(H,22,25)