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

Systemtic Name: 2-[4-(4-tert-butylphenyl)-2-(2-chloranylethanoylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-tert-butylphenyl)-2-[(2-chloroacetyl)amino]thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-tert-butylphenyl)-2-[(2-chloro-1-oxoethyl)amino]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-tert-butylphenyl)-2-[(2-chloroacetyl)amino]-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(4-tert-butylphenyl)-2-[(2-chloroacetyl)amino]thiazol-5-yl]acetic acid Formula: C17H19ClN2O3S MolecularWeight: 366.86236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O3S/c1-17(2,3)11-6-4-10(5-7-11)15-12(8-14(22)23)24-16(20-15)19-13(21)9-18/h4-7H,8-9H2,1-3H3,(H,22,23)(H,19,20,21)