5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-3-(2-methylpropyl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-3-(2-methylpropyl)-2-oxidanyl-benzoic acid Openeye Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-hydroxy-3-isobutyl-benzoic acid CAS Name: 5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-2-hydroxy-3-(2-methylpropyl)benzoic acid IUPAC Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-hydroxy-3-(2-methylpropyl)benzoic acid Traditional Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-hydroxy-3-isobutyl-benzoic acid Formula: C24H27NO5S MolecularWeight: 441.53988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C(=C3)CC(C)C)O)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C(=C3)CC(C)C)O)C(=O)O)OCC

InChI

InChI=1S/C24H27NO5S/c1-5-29-20-8-7-15(12-21(20)30-6-2)23-25-19(13-31-23)16-10-17(9-14(3)4)22(26)18(11-16)24(27)28/h7-8,10-14,26H,5-6,9H2,1-4H3,(H,27,28)