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

Systemtic Name: N-[5-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide Openeye Name: N-[5-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide CAS Name: N-[5-[1-[(4-bromophenyl)methyl]-2-benzimidazolyl]pentyl]-3,4-dimethoxybenzamide IUPAC Name: N-[5-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxybenzamide Traditional Name: N-[5-[1-(4-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=C(C=C4)Br)OC

Isomeric SMILES

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

InChI

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