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

Systemtic Name: N-[3-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]propyl]-3,4-dimethoxy-benzamide Openeye Name: N-[3-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]propyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-[1-[(3-bromophenyl)methyl]-2-benzimidazolyl]propyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]propyl]-3,4-dimethoxybenzamide Traditional Name: N-[3-[1-(3-bromobenzyl)benzimidazol-2-yl]propyl]-3,4-dimethoxy-benzamide Formula: C26H26BrN3O3 MolecularWeight: 508.40694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CC4=CC(=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CC4=CC(=CC=C4)Br)OC

InChI

InChI=1S/C26H26BrN3O3/c1-32-23-13-12-19(16-24(23)33-2)26(31)28-14-6-11-25-29-21-9-3-4-10-22(21)30(25)17-18-7-5-8-20(27)15-18/h3-5,7-10,12-13,15-16H,6,11,14,17H2,1-2H3,(H,28,31)