2-[(2R)-1-(3H-benzimidazol-5-ylmethyl)pyrrolidin-1-ium-2-yl]-1,3-thiazole

Systemtic Name: 2-[(2R)-1-(3H-benzimidazol-5-ylmethyl)pyrrolidin-1-ium-2-yl]-1,3-thiazole Openeye Name: 2-[(2R)-1-(3H-benzimidazol-5-ylmethyl)pyrrolidin-1-ium-2-yl]thiazole CAS Name: 2-[(2R)-1-(3H-benzimidazol-5-ylmethyl)-2-pyrrolidin-1-iumyl]thiazole IUPAC Name: 2-[(2R)-1-(3H-benzimidazol-5-ylmethyl)pyrrolidin-1-ium-2-yl]-1,3-thiazole Traditional Name: 2-[(2R)-1-(3H-benzimidazol-5-ylmethyl)pyrrolidin-1-ium-2-yl]thiazole Formula: C15H17N4S+ MolecularWeight: 285.38728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC3=C(C=C2)N=CN3)C4=NC=CS4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CC3=C(C=C2)N=CN3)C4=NC=CS4

InChI

InChI=1S/C15H16N4S/c1-2-14(15-16-5-7-20-15)19(6-1)9-11-3-4-12-13(8-11)18-10-17-12/h3-5,7-8,10,14H,1-2,6,9H2,(H,17,18)/p+1/t14-/m1/s1