N-(3-methylphenyl)-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]-N-propyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]-N-propyl-ethanamide Openeye Name: N-(m-tolyl)-2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]-N-propyl-acetamide CAS Name: N-(3-methylphenyl)-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]-N-propylacetamide IUPAC Name: N-(3-methylphenyl)-2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]-N-propylacetamide Traditional Name: 2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]-N-(m-tolyl)-N-propyl-acetamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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