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

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-propan-2-ylphenyl)carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-isopropylbenzoyl)amino]phenoxy]acetic acid CAS Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[[oxo-(4-propan-2-ylphenyl)methyl]amino]phenoxy]acetic acid IUPAC Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(4-propan-2-ylbenzoyl)amino]phenoxy]acetic acid Traditional Name: 2-[2-(1,3-benzothiazol-2-yl)-5-(cumoylamino)phenoxy]acetic acid Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H22N2O4S/c1-15(2)16-7-9-17(10-8-16)24(30)26-18-11-12-19(21(13-18)31-14-23(28)29)25-27-20-5-3-4-6-22(20)32-25/h3-13,15H,14H2,1-2H3,(H,26,30)(H,28,29)