N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-pyrrolidin-1-yl-6-thiophen-2-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-pyrrolidin-1-yl-6-thiophen-2-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-pyrrolidin-1-yl-6-(2-thienyl)pyridin-1-ium-3-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-(1-pyrrolidinyl)-6-thiophen-2-yl-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-pyrrolidin-1-yl-6-thiophen-2-ylpyridin-1-ium-3-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-pyrrolidino-6-(2-thienyl)pyridin-1-ium-3-carboxamide Formula: C23H24N5OS+ MolecularWeight: 418.53456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=C([NH+]=C(C=C3)C4=CC=CS4)N5CCCC5

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=C([NH+]=C(C=C3)C4=CC=CS4)N5CCCC5

InChI

InChI=1S/C23H23N5OS/c1-15(21-25-17-7-2-3-8-18(17)26-21)24-23(29)16-10-11-19(20-9-6-14-30-20)27-22(16)28-12-4-5-13-28/h2-3,6-11,14-15H,4-5,12-13H2,1H3,(H,24,29)(H,25,26)/p+1/t15-/m0/s1