N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-4-bromanyl-benzamide

Systemtic Name: N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-4-bromanyl-benzamide Openeye Name: N-[2-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-4-bromo-benzamide CAS Name: N-[2-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]ethyl]-4-bromobenzamide IUPAC Name: N-[2-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]ethyl]-4-bromobenzamide Traditional Name: N-[2-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]ethyl]-4-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=C(C=C4)Br

Isomeric SMILES

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

InChI

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