3-methyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]thiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]thiophene-2-carboxamide Openeye Name: 3-methyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]thiophene-2-carboxamide CAS Name: 3-methyl-N-[1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: 3-methyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]thiophene-2-carboxamide Traditional Name: 3-methyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]thiophene-2-carboxamide Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4

Isomeric SMILES

CC1=C(SC=C1)C(=O)NC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4

InChI

InChI=1S/C20H24N4OS/c1-15-9-14-26-18(15)19(25)22-20-21-16-7-3-4-8-17(16)24(20)13-12-23-10-5-2-6-11-23/h3-4,7-9,14H,2,5-6,10-13H2,1H3,(H,21,22,25)/p+1