2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide Formula: C21H25N4OS+ MolecularWeight: 381.5144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC=C(C=C3)C[NH+]4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC=C(C=C3)C[NH+]4CCCC4

InChI

InChI=1S/C21H24N4OS/c1-15-4-9-18-19(12-15)24-21(23-18)27-14-20(26)22-17-7-5-16(6-8-17)13-25-10-2-3-11-25/h4-9,12H,2-3,10-11,13-14H2,1H3,(H,22,26)(H,23,24)/p+1