N-(2-imidazol-1-ylethyl)-5-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(2-imidazol-1-ylethyl)-5-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(2-imidazol-1-ylethyl)-5-[(2R)-1-(thiazol-2-ylmethyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-[2-(1-imidazolyl)ethyl]-5-[(2R)-1-(2-thiazolylmethyl)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(2-imidazol-1-ylethyl)-5-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(2-imidazol-1-ylethyl)-5-[(2R)-1-(thiazol-2-ylmethyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C18H22N5OS2+ MolecularWeight: 388.53018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=NC=CS2)C3=CC=C(S3)C(=O)NCCN4C=CN=C4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=NC=CS2)C3=CC=C(S3)C(=O)NCCN4C=CN=C4

InChI

InChI=1S/C18H21N5OS2/c24-18(21-6-10-22-9-5-19-13-22)16-4-3-15(26-16)14-2-1-8-23(14)12-17-20-7-11-25-17/h3-5,7,9,11,13-14H,1-2,6,8,10,12H2,(H,21,24)/p+1/t14-/m1/s1