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

Systemtic Name: 2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]-N-pyridin-3-yl-ethanamide Openeye Name: 2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]-N-(3-pyridyl)acetamide CAS Name: 2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]-N-(3-pyridinyl)acetamide IUPAC Name: 2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]-N-pyridin-3-ylacetamide Traditional Name: 2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]-N-(3-pyridyl)acetamide Formula: C21H17N5O2 MolecularWeight: 371.39198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CN=CC=C3)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CN=CC=C3)CC4=CC=NC=C4

InChI

InChI=1S/C21H17N5O2/c27-20(24-16-4-3-9-23-13-16)14-26-21(28)18-6-2-1-5-17(18)19(25-26)12-15-7-10-22-11-8-15/h1-11,13H,12,14H2,(H,24,27)