2-[[4,5-bis(4-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4,5-bis(4-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[4,5-bis(4-isopropoxyphenyl)oxazol-2-yl]sulfanylacetic acid CAS Name: 2-[[4,5-bis(4-propan-2-yloxyphenyl)-2-oxazolyl]thio]acetic acid IUPAC Name: 2-[[4,5-bis(4-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4,5-bis(4-isopropoxyphenyl)oxazol-2-yl]thio]acetic acid Formula: C23H25NO5S MolecularWeight: 427.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)O)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)O)C3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C23H25NO5S/c1-14(2)27-18-9-5-16(6-10-18)21-22(29-23(24-21)30-13-20(25)26)17-7-11-19(12-8-17)28-15(3)4/h5-12,14-15H,13H2,1-4H3,(H,25,26)