4-(5-ethyl-2-methyl-1,3-thiazol-4-yl)benzoic acid

Systemtic Name: 4-(5-ethyl-2-methyl-1,3-thiazol-4-yl)benzoic acid Openeye Name: 4-(5-ethyl-2-methyl-thiazol-4-yl)benzoic acid CAS Name: 4-(5-ethyl-2-methyl-4-thiazolyl)benzoic acid IUPAC Name: 4-(5-ethyl-2-methyl-1,3-thiazol-4-yl)benzoic acid Traditional Name: 4-(5-ethyl-2-methyl-thiazol-4-yl)benzoic acid Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)C)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC1=C(N=C(S1)C)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13NO2S/c1-3-11-12(14-8(2)17-11)9-4-6-10(7-5-9)13(15)16/h4-7H,3H2,1-2H3,(H,15,16)