N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanamide

Systemtic Name: N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-[3-(3,5-dimethyl-1-piperidyl)propyl]-2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-[3-(3,5-dimethyl-1-piperidinyl)propyl]-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-[3-(3,5-dimethylpiperidino)propyl]-2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)CCCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4)C

InChI

InChI=1S/C26H33N5O2/c1-19-13-20(2)17-30(16-19)12-6-11-28-25(32)18-31-26(33)23-9-4-3-8-22(23)24(29-31)14-21-7-5-10-27-15-21/h3-5,7-10,15,19-20H,6,11-14,16-18H2,1-2H3,(H,28,32)