N-[1-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-3-bromanyl-benzamide

Systemtic Name: N-[1-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-3-bromanyl-benzamide Openeye Name: N-[1-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-3-bromo-benzamide CAS Name: N-[1-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]ethyl]-3-bromobenzamide IUPAC Name: N-[1-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]ethyl]-3-bromobenzamide Traditional Name: N-[1-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]ethyl]-3-bromo-benzamide Formula: C25H29BrN4O2 MolecularWeight: 497.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1CCC(=O)N3CCCCCC3)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC(C1=NC2=CC=CC=C2N1CCC(=O)N3CCCCCC3)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C25H29BrN4O2/c1-18(27-25(32)19-9-8-10-20(26)17-19)24-28-21-11-4-5-12-22(21)30(24)16-13-23(31)29-14-6-2-3-7-15-29/h4-5,8-12,17-18H,2-3,6-7,13-16H2,1H3,(H,27,32)