2-[(4-chloranylphenoxy)methyl]-4-methyl-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzimidazole

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-4-methyl-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzimidazole Openeye Name: 2-[(4-chlorophenoxy)methyl]-4-methyl-1-[3-[4-(2-pyridyl)piperazin-1-yl]propyl]benzimidazole CAS Name: 2-[(4-chlorophenoxy)methyl]-4-methyl-1-[3-[4-(2-pyridinyl)-1-piperazinyl]propyl]benzimidazole IUPAC Name: 2-[(4-chlorophenoxy)methyl]-4-methyl-1-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzimidazole Traditional Name: 2-[(4-chlorophenoxy)methyl]-4-methyl-1-[3-[4-(2-pyridyl)piperazino]propyl]benzimidazole Formula: C27H30ClN5O MolecularWeight: 476.013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCCN4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCCN4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C27H30ClN5O/c1-21-6-4-7-24-27(21)30-26(20-34-23-11-9-22(28)10-12-23)33(24)15-5-14-31-16-18-32(19-17-31)25-8-2-3-13-29-25/h2-4,6-13H,5,14-20H2,1H3