4-[2-(2-azanyl-1,3-thiazol-4-yl)ethyl]benzoic acid

Systemtic Name: 4-[2-(2-azanyl-1,3-thiazol-4-yl)ethyl]benzoic acid Openeye Name: 4-[2-(2-aminothiazol-4-yl)ethyl]benzoic acid CAS Name: 4-[2-(2-amino-4-thiazolyl)ethyl]benzoic acid IUPAC Name: 4-[2-(2-amino-1,3-thiazol-4-yl)ethyl]benzoic acid Traditional Name: 4-[2-(2-aminothiazol-4-yl)ethyl]benzoic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CSC(=N2)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC2=CSC(=N2)N)C(=O)O

InChI

InChI=1S/C12H12N2O2S/c13-12-14-10(7-17-12)6-3-8-1-4-9(5-2-8)11(15)16/h1-2,4-5,7H,3,6H2,(H2,13,14)(H,15,16)