N-[1-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]thiophene-2-carboxamide Openeye Name: N-[1-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]thiophene-2-carboxamide CAS Name: N-[1-ethyl-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: N-[1-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]thiophene-2-carboxamide Traditional Name: N-[1-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]thiophene-2-carboxamide Formula: C21H27N4OS+ MolecularWeight: 383.53028

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1C[NH+]4CCC(CC4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1C[NH+]4CCC(CC4)C

InChI

InChI=1S/C21H26N4OS/c1-3-25-18-7-6-16(22-21(26)19-5-4-12-27-19)13-17(18)23-20(25)14-24-10-8-15(2)9-11-24/h4-7,12-13,15H,3,8-11,14H2,1-2H3,(H,22,26)/p+1