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

Systemtic Name: (2R)-1-(pyridin-3-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-(3-pyridylmethyl)-N-(4-thiazol-4-ylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-(3-pyridinylmethyl)-N-[4-(4-thiazolyl)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-(pyridin-3-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(3-pyridylmethyl)-N-(4-thiazol-4-ylphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C20H21N4OS+ MolecularWeight: 365.47194

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)C4=CSC=N4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)C4=CSC=N4

InChI

InChI=1S/C20H20N4OS/c25-20(19-4-2-10-24(19)12-15-3-1-9-21-11-15)23-17-7-5-16(6-8-17)18-13-26-14-22-18/h1,3,5-9,11,13-14,19H,2,4,10,12H2,(H,23,25)/p+1/t19-/m1/s1