(2R)-1-(1H-imidazol-5-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-(4-thiazol-4-ylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[4-(4-thiazolyl)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-(4-thiazol-4-ylphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C18H20N5OS+ MolecularWeight: 354.4493

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CN=CN2)C(=O)NC3=CC=C(C=C3)C4=CSC=N4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CN=CN2)C(=O)NC3=CC=C(C=C3)C4=CSC=N4

InChI

InChI=1S/C18H19N5OS/c24-18(17-2-1-7-23(17)9-15-8-19-11-20-15)22-14-5-3-13(4-6-14)16-10-25-12-21-16/h3-6,8,10-12,17H,1-2,7,9H2,(H,19,20)(H,22,24)/p+1/t17-/m1/s1