2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide

Systemtic Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide Openeye Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide CAS Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]-N-[2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Traditional Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Formula: C17H25N4OS+ MolecularWeight: 333.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)SCC(=O)NCC[NH+]3CCCC3

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)SCC(=O)NCC[NH+]3CCCC3

InChI

InChI=1S/C17H24N4OS/c1-12-9-14-15(10-13(12)2)20-17(19-14)23-11-16(22)18-5-8-21-6-3-4-7-21/h9-10H,3-8,11H2,1-2H3,(H,18,22)(H,19,20)/p+1