2-(3-methylphenyl)-6-[2-(4-methylpiperazin-1-yl)ethoxy]-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-(3-methylphenyl)-6-[2-(4-methylpiperazin-1-yl)ethoxy]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]-2-(m-tolyl)benzimidazole CAS Name: 2-(3-methylphenyl)-6-[2-(4-methyl-1-piperazinyl)ethoxy]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-(3-methylphenyl)-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzimidazole Traditional Name: 1-benzyl-6-[2-(4-methylpiperazino)ethoxy]-2-(m-tolyl)benzimidazole Formula: C28H32N4O MolecularWeight: 440.57988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(N2CC4=CC=CC=C4)C=C(C=C3)OCCN5CCN(CC5)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(N2CC4=CC=CC=C4)C=C(C=C3)OCCN5CCN(CC5)C

InChI

InChI=1S/C28H32N4O/c1-22-7-6-10-24(19-22)28-29-26-12-11-25(33-18-17-31-15-13-30(2)14-16-31)20-27(26)32(28)21-23-8-4-3-5-9-23/h3-12,19-20H,13-18,21H2,1-2H3