4-[2-[2-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-propan-2-yl-phthalazin-1-one

Systemtic Name: 4-[2-[2-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-propan-2-yl-phthalazin-1-one Openeye Name: 4-[2-[2-(1H-benzimidazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-2-isopropyl-phthalazin-1-one CAS Name: 4-[2-[2-(1H-benzimidazol-2-yl)-1-piperidinyl]-2-oxoethyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 4-[2-[2-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxoethyl]-2-propan-2-ylphthalazin-1-one Traditional Name: 4-[2-[2-(1H-benzimidazol-2-yl)piperidino]-2-keto-ethyl]-2-isopropyl-phthalazin-1-one Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCCCC3C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCCCC3C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H27N5O2/c1-16(2)30-25(32)18-10-4-3-9-17(18)21(28-30)15-23(31)29-14-8-7-13-22(29)24-26-19-11-5-6-12-20(19)27-24/h3-6,9-12,16,22H,7-8,13-15H2,1-2H3,(H,26,27)