3-[1-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[[2-(2-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one CAS Name: 3-[1-[(2-thiophen-2-yl-4-oxazolyl)methyl]-4-piperidin-1-iumyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[[2-(2-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Formula: C20H21N4O2S+ MolecularWeight: 381.47134

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C3=CC=CC=C3NC2=O)CC4=COC(=N4)C5=CC=CS5

Isomeric SMILES

C1C[NH+](CCC1N2C3=CC=CC=C3NC2=O)CC4=COC(=N4)C5=CC=CS5

InChI

InChI=1S/C20H20N4O2S/c25-20-22-16-4-1-2-5-17(16)24(20)15-7-9-23(10-8-15)12-14-13-26-19(21-14)18-6-3-11-27-18/h1-6,11,13,15H,7-10,12H2,(H,22,25)/p+1