3-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]butanoic acid

Systemtic Name: 3-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]butanoic acid Openeye Name: 3-[4,5-bis(4-chlorophenyl)oxazol-2-yl]sulfanylbutanoic acid CAS Name: 3-[[4,5-bis(4-chlorophenyl)-2-oxazolyl]thio]butanoic acid IUPAC Name: 3-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]butanoic acid Traditional Name: 3-[[4,5-bis(4-chlorophenyl)oxazol-2-yl]thio]butyric acid Formula: C19H15Cl2NO3S MolecularWeight: 408.2983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)SC1=NC(=C(O1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(CC(=O)O)SC1=NC(=C(O1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15Cl2NO3S/c1-11(10-16(23)24)26-19-22-17(12-2-6-14(20)7-3-12)18(25-19)13-4-8-15(21)9-5-13/h2-9,11H,10H2,1H3,(H,23,24)