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

Systemtic Name: 2-[[4,5-bis(4-tert-butylphenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[4,5-bis(4-tert-butylphenyl)oxazol-2-yl]sulfanylacetic acid CAS Name: 2-[[4,5-bis(4-tert-butylphenyl)-2-oxazolyl]thio]acetic acid IUPAC Name: 2-[[4,5-bis(4-tert-butylphenyl)-1,3-oxazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4,5-bis(4-tert-butylphenyl)oxazol-2-yl]thio]acetic acid Formula: C25H29NO3S MolecularWeight: 423.56766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO3S/c1-24(2,3)18-11-7-16(8-12-18)21-22(29-23(26-21)30-15-20(27)28)17-9-13-19(14-10-17)25(4,5)6/h7-14H,15H2,1-6H3,(H,27,28)