2-[5-[2-(4-bromophenyl)phenyl]-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid

Systemtic Name: 2-[5-[2-(4-bromophenyl)phenyl]-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid Openeye Name: 2-[5-[2-(4-bromophenyl)phenyl]oxazol-2-yl]-2-sulfanyl-acetic acid CAS Name: 2-[5-[2-(4-bromophenyl)phenyl]-2-oxazolyl]-2-mercaptoacetic acid IUPAC Name: 2-[5-[2-(4-bromophenyl)phenyl]-1,3-oxazol-2-yl]-2-sulfanylacetic acid Traditional Name: 2-[5-[2-(4-bromophenyl)phenyl]oxazol-2-yl]-2-mercapto-acetic acid Formula: C17H12BrNO3S MolecularWeight: 390.25108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)Br)C3=CN=C(O3)C(C(=O)O)S

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)Br)C3=CN=C(O3)C(C(=O)O)S

InChI

InChI=1S/C17H12BrNO3S/c18-11-7-5-10(6-8-11)12-3-1-2-4-13(12)14-9-19-16(22-14)15(23)17(20)21/h1-9,15,23H,(H,20,21)