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

Systemtic Name: N-(3-cyanophenyl)-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-(3-cyanophenyl)-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-(3-cyanophenyl)-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-(3-cyanophenyl)-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-(3-cyanophenyl)-2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C23H17N5O2 MolecularWeight: 395.41338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17N5O2/c24-14-17-4-3-5-18(12-17)26-22(29)15-28-23(30)20-7-2-1-6-19(20)21(27-28)13-16-8-10-25-11-9-16/h1-12H,13,15H2,(H,26,29)