N-[5-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[5-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide Openeye Name: N-[5-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide CAS Name: N-[5-[1-[(3-bromophenyl)methyl]-2-benzimidazolyl]pentyl]-3,4-dimethoxybenzamide IUPAC Name: N-[5-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxybenzamide Traditional Name: N-[5-[1-(3-bromobenzyl)benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide Formula: C28H30BrN3O3 MolecularWeight: 536.4601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCCCCC2=NC3=CC=CC=C3N2CC4=CC(=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCCCCC2=NC3=CC=CC=C3N2CC4=CC(=CC=C4)Br)OC

InChI

InChI=1S/C28H30BrN3O3/c1-34-25-15-14-21(18-26(25)35-2)28(33)30-16-7-3-4-13-27-31-23-11-5-6-12-24(23)32(27)19-20-9-8-10-22(29)17-20/h5-6,8-12,14-15,17-18H,3-4,7,13,16,19H2,1-2H3,(H,30,33)