2-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl]-1-oxidanyl-ethanesulfonic acid

Systemtic Name: 2-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl]-1-oxidanyl-ethanesulfonic acid Openeye Name: 2-[4,5-bis(4-methoxyphenyl)thiazol-2-yl]sulfanyl-1-hydroxy-ethanesulfonic acid CAS Name: 2-[[4,5-bis(4-methoxyphenyl)-2-thiazolyl]thio]-1-hydroxyethanesulfonic acid IUPAC Name: 2-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl]-1-hydroxyethanesulfonic acid Traditional Name: 2-[[4,5-bis(4-methoxyphenyl)thiazol-2-yl]thio]-1-hydroxy-ethanesulfonic acid Formula: C19H19NO6S3 MolecularWeight: 453.55226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(SC(=N2)SCC(O)S(=O)(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(SC(=N2)SCC(O)S(=O)(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H19NO6S3/c1-25-14-7-3-12(4-8-14)17-18(13-5-9-15(26-2)10-6-13)28-19(20-17)27-11-16(21)29(22,23)24/h3-10,16,21H,11H2,1-2H3,(H,22,23,24)