2-[4-(4-tert-butylphenyl)-2-(3-methylbutanoylamino)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-tert-butylphenyl)-2-(3-methylbutanoylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-tert-butylphenyl)-2-(3-methylbutanoylamino)thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-tert-butylphenyl)-2-[(3-methyl-1-oxobutyl)amino]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-tert-butylphenyl)-2-(3-methylbutanoylamino)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(4-tert-butylphenyl)-2-(isovalerylamino)thiazol-5-yl]acetic acid Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NC(=C(S1)CC(=O)O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)CC(=O)NC1=NC(=C(S1)CC(=O)O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H26N2O3S/c1-12(2)10-16(23)21-19-22-18(15(26-19)11-17(24)25)13-6-8-14(9-7-13)20(3,4)5/h6-9,12H,10-11H2,1-5H3,(H,24,25)(H,21,22,23)