N-(1-methylpiperidin-1-ium-4-yl)-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-(1-methylpiperidin-1-ium-4-yl)-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-(1-methylpiperidin-1-ium-4-yl)-3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]propanamide CAS Name: N-(1-methyl-4-piperidin-1-iumyl)-3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-(1-methylpiperidin-1-ium-4-yl)-3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-(1-methylpiperidin-1-ium-4-yl)-3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)propionamide Formula: C22H34N5O3S+ MolecularWeight: 448.60206

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H33N5O3S/c1-25-14-10-17(11-15-25)23-22(28)9-8-21-24-19-16-18(6-7-20(19)26(21)2)31(29,30)27-12-4-3-5-13-27/h6-7,16-17H,3-5,8-15H2,1-2H3,(H,23,28)/p+1