N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(5-benzylthiazol-2-yl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[5-(phenylmethyl)-2-thiazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(5-benzylthiazol-2-yl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C16H20N3OS+ MolecularWeight: 302.4145

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=NC=C(S2)CC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=NC=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c20-15(12-19-8-4-5-9-19)18-16-17-11-14(21-16)10-13-6-2-1-3-7-13/h1-3,6-7,11H,4-5,8-10,12H2,(H,17,18,20)/p+1