4-[[6-oxidanyl-5,7-di(propan-2-yl)-1,3-benzothiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[6-oxidanyl-5,7-di(propan-2-yl)-1,3-benzothiazol-2-yl]amino]benzoic acid Openeye Name: 4-[(6-hydroxy-5,7-diisopropyl-1,3-benzothiazol-2-yl)amino]benzoic acid CAS Name: 4-[[6-hydroxy-5,7-di(propan-2-yl)-1,3-benzothiazol-2-yl]amino]benzoic acid IUPAC Name: 4-[[6-hydroxy-5,7-di(propan-2-yl)-1,3-benzothiazol-2-yl]amino]benzoic acid Traditional Name: 4-[(6-hydroxy-5,7-diisopropyl-1,3-benzothiazol-2-yl)amino]benzoic acid Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C(=C1O)C(C)C)SC(=N2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC2=C(C(=C1O)C(C)C)SC(=N2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H22N2O3S/c1-10(2)14-9-15-18(16(11(3)4)17(14)23)26-20(22-15)21-13-7-5-12(6-8-13)19(24)25/h5-11,23H,1-4H3,(H,21,22)(H,24,25)