N-(1H-imidazol-2-ylmethyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C13H17N4OS+ MolecularWeight: 277.36528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=CC=C(S2)C(=O)NCC3=NC=CN3

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C2=CC=C(S2)C(=O)NCC3=NC=CN3

InChI

InChI=1S/C13H16N4OS/c18-13(17-8-12-15-6-7-16-12)11-4-3-10(19-11)9-2-1-5-14-9/h3-4,6-7,9,14H,1-2,5,8H2,(H,15,16)(H,17,18)/p+1/t9-/m1/s1