N-piperidin-4-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine hydrate trihydrobromide

Systemtic Name: N-piperidin-4-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine hydrate trihydrobromide Openeye Name: N-(4-piperidyl)-1-(thiazol-4-ylmethyl)benzimidazol-2-amine hydrate trihydrobromide CAS Name: N-(4-piperidinyl)-1-(4-thiazolylmethyl)-2-benzimidazolamine hydrate trihydrobromide IUPAC Name: N-piperidin-4-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine hydrate trihydrobromide Traditional Name: 4-piperidyl-[1-(thiazol-4-ylmethyl)benzimidazol-2-yl]amine hydrate trihydrobromide Formula: C16H24Br3N5OS MolecularWeight: 574.17166

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC2=NC3=CC=CC=C3N2CC4=CSC=N4.O.Br.Br.Br

Isomeric SMILES

C1CNCCC1NC2=NC3=CC=CC=C3N2CC4=CSC=N4.O.Br.Br.Br

InChI

InChI=1S/C16H19N5S.3BrH.H2O/c1-2-4-15-14(3-1)20-16(19-12-5-7-17-8-6-12)21(15)9-13-10-22-11-18-13;;;;/h1-4,10-12,17H,5-9H2,(H,19,20);3*1H;1H2