2-[2-(3-oxidanylpropylamino)benzimidazol-1-yl]-1-thiophen-2-yl-ethanone hydrobromide

Systemtic Name: 2-[2-(3-oxidanylpropylamino)benzimidazol-1-yl]-1-thiophen-2-yl-ethanone hydrobromide Openeye Name: 2-[2-(3-hydroxypropylamino)benzimidazol-1-yl]-1-(2-thienyl)ethanone hydrobromide CAS Name: 2-[2-(3-hydroxypropylamino)-1-benzimidazolyl]-1-thiophen-2-ylethanone hydrobromide IUPAC Name: 2-[2-(3-hydroxypropylamino)benzimidazol-1-yl]-1-thiophen-2-ylethanone hydrobromide Traditional Name: 2-[2-(3-hydroxypropylamino)benzimidazol-1-yl]-1-(2-thienyl)ethanone hydrobromide Formula: C16H18BrN3O2S MolecularWeight: 396.30202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC(=O)C3=CC=CS3)NCCCO.Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC(=O)C3=CC=CS3)NCCCO.Br

InChI

InChI=1S/C16H17N3O2S.BrH/c20-9-4-8-17-16-18-12-5-1-2-6-13(12)19(16)11-14(21)15-7-3-10-22-15;/h1-3,5-7,10,20H,4,8-9,11H2,(H,17,18);1H