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

Systemtic Name: N-[3-(diethylamino)propyl]-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-[3-(diethylamino)propyl]-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-[3-(diethylamino)propyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-[3-(diethylamino)propyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-[3-(diethylamino)propyl]-2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3

Isomeric SMILES

CCN(CC)CCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3

InChI

InChI=1S/C23H29N5O2/c1-3-27(4-2)15-7-12-25-22(29)17-28-23(30)20-9-6-5-8-19(20)21(26-28)16-18-10-13-24-14-11-18/h5-6,8-11,13-14H,3-4,7,12,15-17H2,1-2H3,(H,25,29)