2-[2-(1,3-benzothiazol-2-yl)-5-[(4-tert-butylphenyl)carbonylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-tert-butylphenyl)carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-tert-butylbenzoyl)amino]phenoxy]acetic acid CAS Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[[(4-tert-butylphenyl)-oxomethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-tert-butylbenzoyl)amino]phenoxy]acetic acid Traditional Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-tert-butylbenzoyl)amino]phenoxy]acetic acid Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)OCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)OCC(=O)O

InChI

InChI=1S/C26H24N2O4S/c1-26(2,3)17-10-8-16(9-11-17)24(31)27-18-12-13-19(21(14-18)32-15-23(29)30)25-28-20-6-4-5-7-22(20)33-25/h4-14H,15H2,1-3H3,(H,27,31)(H,29,30)