2-[2-(1,3-benzothiazol-2-yl)-5-(2-phenylethanoylamino)phenoxy]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yl)-5-(2-phenylethanoylamino)phenoxy]ethanoic acid Openeye Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(2-phenylacetyl)amino]phenoxy]acetic acid CAS Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(1-oxo-2-phenylethyl)amino]phenoxy]acetic acid IUPAC Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(2-phenylacetyl)amino]phenoxy]acetic acid Traditional Name: 2-[2-(1,3-benzothiazol-2-yl)-5-[(2-phenylacetyl)amino]phenoxy]acetic acid Formula: C23H18N2O4S MolecularWeight: 418.46502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N2O4S/c26-21(12-15-6-2-1-3-7-15)24-16-10-11-17(19(13-16)29-14-22(27)28)23-25-18-8-4-5-9-20(18)30-23/h1-11,13H,12,14H2,(H,24,26)(H,27,28)