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

Systemtic Name: N-(2-diethylaminoethyl)-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-(2-diethylaminoethyl)-2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-(2-diethylaminoethyl)-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-(2-diethylaminoethyl)-2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-(2-diethylaminoethyl)-2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN=CC=C3

Isomeric SMILES

CCN(CC)CCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN=CC=C3

InChI

InChI=1S/C22H27N5O2/c1-3-26(4-2)13-12-24-21(28)16-27-22(29)19-10-6-5-9-18(19)20(25-27)14-17-8-7-11-23-15-17/h5-11,15H,3-4,12-14,16H2,1-2H3,(H,24,28)