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

Systemtic Name: N-[5-[(3-bromophenyl)methyl]-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-[(3-bromophenyl)methyl]thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[5-[(3-bromophenyl)methyl]-2-thiazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[5-[(3-bromophenyl)methyl]-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[5-(3-bromobenzyl)thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C16H19BrN3OS+ MolecularWeight: 381.31056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrN3OS/c17-13-5-3-4-12(8-13)9-14-10-18-16(22-14)19-15(21)11-20-6-1-2-7-20/h3-5,8,10H,1-2,6-7,9,11H2,(H,18,19,21)/p+1