2-[2-acetamido-4-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-acetamido-4-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-acetamido-4-(4-isopropylphenyl)thiazol-5-yl]acetic acid CAS Name: 2-[2-acetamido-4-(4-propan-2-ylphenyl)-5-thiazolyl]acetic acid IUPAC Name: 2-[2-acetamido-4-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-(2-acetamido-4-p-cumenyl-thiazol-5-yl)acetic acid Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C)CC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C)CC(=O)O

InChI

InChI=1S/C16H18N2O3S/c1-9(2)11-4-6-12(7-5-11)15-13(8-14(20)21)22-16(18-15)17-10(3)19/h4-7,9H,8H2,1-3H3,(H,20,21)(H,17,18,19)