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

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

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C25H29BrN4O2/c26-20-9-7-8-19(18-20)25(32)27-14-12-23-28-21-10-3-4-11-22(21)30(23)17-13-24(31)29-15-5-1-2-6-16-29/h3-4,7-11,18H,1-2,5-6,12-17H2,(H,27,32)