3-[3-[4-[(4-chlorophenyl)-pyridin-3-yl-methyl]piperazin-1-yl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[4-[(4-chlorophenyl)-pyridin-3-yl-methyl]piperazin-1-yl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[4-[(4-chlorophenyl)-(3-pyridyl)methyl]piperazin-1-yl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[4-[(4-chlorophenyl)-(3-pyridinyl)methyl]-1-piperazinyl]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[4-[(4-chlorophenyl)-pyridin-3-ylmethyl]piperazin-1-yl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[4-[(4-chlorophenyl)-(3-pyridyl)methyl]piperazino]propyl]-1H-benzimidazol-2-one Formula: C26H28ClN5O MolecularWeight: 461.98642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C3=CC=CC=C3NC2=O)C(C4=CC=C(C=C4)Cl)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCN1CCCN2C3=CC=CC=C3NC2=O)C(C4=CC=C(C=C4)Cl)C5=CN=CC=C5

InChI

InChI=1S/C26H28ClN5O/c27-22-10-8-20(9-11-22)25(21-5-3-12-28-19-21)31-17-15-30(16-18-31)13-4-14-32-24-7-2-1-6-23(24)29-26(32)33/h1-3,5-12,19,25H,4,13-18H2,(H,29,33)