3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]benzoic acid

Systemtic Name: 3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]benzoic acid Openeye Name: 3-[1-(2,5-dimethylthiazol-4-yl)ethylamino]benzoic acid CAS Name: 3-[1-(2,5-dimethyl-4-thiazolyl)ethylamino]benzoic acid IUPAC Name: 3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]benzoic acid Traditional Name: 3-[1-(2,5-dimethylthiazol-4-yl)ethylamino]benzoic acid Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C)C(C)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=C(N=C(S1)C)C(C)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H16N2O2S/c1-8(13-9(2)19-10(3)16-13)15-12-6-4-5-11(7-12)14(17)18/h4-8,15H,1-3H3,(H,17,18)