3-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[oxo-[4-[[2-(phenoxymethyl)-1-benzimidazolyl]methyl]-1-piperidinyl]methyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidine-1-carbonyl]-1H-pyridazin-6-one Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C3=CC=CC=C3N=C2COC4=CC=CC=C4)C(=O)C5=NNC(=O)C=C5

Isomeric SMILES

C1CN(CCC1CN2C3=CC=CC=C3N=C2COC4=CC=CC=C4)C(=O)C5=NNC(=O)C=C5

InChI

InChI=1S/C25H25N5O3/c31-24-11-10-21(27-28-24)25(32)29-14-12-18(13-15-29)16-30-22-9-5-4-8-20(22)26-23(30)17-33-19-6-2-1-3-7-19/h1-11,18H,12-17H2,(H,28,31)