4-[[4-(4-benzamidophenyl)-1,3-thiazol-2-yl]-propan-2-yl-amino]benzoic acid

Systemtic Name: 4-[[4-(4-benzamidophenyl)-1,3-thiazol-2-yl]-propan-2-yl-amino]benzoic acid Openeye Name: 4-[[4-(4-benzamidophenyl)thiazol-2-yl]-isopropyl-amino]benzoic acid CAS Name: 4-[[4-(4-benzamidophenyl)-2-thiazolyl]-propan-2-ylamino]benzoic acid IUPAC Name: 4-[[4-(4-benzamidophenyl)-1,3-thiazol-2-yl]-propan-2-ylamino]benzoic acid Traditional Name: 4-[[4-(4-benzamidophenyl)thiazol-2-yl]-isopropyl-amino]benzoic acid Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)C(=O)O)C2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)C(=O)O)C2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3S/c1-17(2)29(22-14-10-20(11-15-22)25(31)32)26-28-23(16-33-26)18-8-12-21(13-9-18)27-24(30)19-6-4-3-5-7-19/h3-17H,1-2H3,(H,27,30)(H,31,32)