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

Systemtic Name: N-(2-methylphenyl)-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]-N-propyl-ethanamide Openeye Name: N-(o-tolyl)-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]-N-propyl-acetamide CAS Name: N-(2-methylphenyl)-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]-N-propylacetamide IUPAC Name: N-(2-methylphenyl)-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]-N-propylacetamide Traditional Name: 2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]-N-(o-tolyl)-N-propyl-acetamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

Isomeric SMILES

CCCN(C1=CC=CC=C1C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

InChI

InChI=1S/C26H26N4O2/c1-3-16-29(24-11-7-4-8-19(24)2)25(31)18-30-26(32)22-10-6-5-9-21(22)23(28-30)17-20-12-14-27-15-13-20/h4-15H,3,16-18H2,1-2H3