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

Systemtic Name: 3-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]benzoic acid Openeye Name: 3-[(4-isopropylthiazol-2-yl)methyl]benzoic acid CAS Name: 3-[(4-propan-2-yl-2-thiazolyl)methyl]benzoic acid IUPAC Name: 3-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]benzoic acid Traditional Name: 3-[(4-isopropylthiazol-2-yl)methyl]benzoic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)C1=CSC(=N1)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H15NO2S/c1-9(2)12-8-18-13(15-12)7-10-4-3-5-11(6-10)14(16)17/h3-6,8-9H,7H2,1-2H3,(H,16,17)