N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide

Systemtic Name: N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-[3-(2,6-dimethyl-1-piperidyl)propyl]-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-[3-(2,6-dimethyl-1-piperidinyl)propyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-[3-(2,6-dimethylpiperidino)propyl]-2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4)C

Isomeric SMILES

CC1CCCC(N1CCCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4)C

InChI

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