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

Systemtic Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4

Isomeric SMILES

CCN1CCCC1CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-2-27-12-6-8-18(27)15-25-22(29)16-28-23(30)20-10-4-3-9-19(20)21(26-28)13-17-7-5-11-24-14-17/h3-5,7,9-11,14,18H,2,6,8,12-13,15-16H2,1H3,(H,25,29)