2-[4-(4-methylphenyl)-2-(2-methylpropanoylamino)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methylphenyl)-2-(2-methylpropanoylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-(2-methylpropanoylamino)-4-(p-tolyl)thiazol-5-yl]acetic acid CAS Name: 2-[2-[(2-methyl-1-oxopropyl)amino]-4-(4-methylphenyl)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-methylphenyl)-2-(2-methylpropanoylamino)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-(isobutyrylamino)-4-(p-tolyl)thiazol-5-yl]acetic acid Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C(C)C)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C(C)C)CC(=O)O

InChI

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