2-[4-(4-ethylphenyl)-2-(propanoylamino)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-ethylphenyl)-2-(propanoylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-ethylphenyl)-2-(propanoylamino)thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-ethylphenyl)-2-(1-oxopropylamino)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-ethylphenyl)-2-(propanoylamino)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(4-ethylphenyl)-2-propionamido-thiazol-5-yl]acetic acid Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CC)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CC)CC(=O)O

InChI

InChI=1S/C16H18N2O3S/c1-3-10-5-7-11(8-6-10)15-12(9-14(20)21)22-16(18-15)17-13(19)4-2/h5-8H,3-4,9H2,1-2H3,(H,20,21)(H,17,18,19)