2-[4-(4-chlorophenyl)-2-(3-methylbutanoylamino)-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[4-(4-chlorophenyl)-2-(3-methylbutanoylamino)-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[4-(4-chlorophenyl)-2-(3-methylbutanoylamino)thiazol-5-yl]acetate CAS Name: 2-[4-(4-chlorophenyl)-2-[(3-methyl-1-oxobutyl)amino]-5-thiazolyl]acetate IUPAC Name: 2-[4-(4-chlorophenyl)-2-(3-methylbutanoylamino)-1,3-thiazol-5-yl]acetate Traditional Name: 2-[4-(4-chlorophenyl)-2-(isovalerylamino)thiazol-5-yl]acetate Formula: C16H16ClN2O3S- MolecularWeight: 351.82784

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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)Cl

Isomeric SMILES

CC(C)CC(=O)NC1=NC(=C(S1)CC(=O)[O-])C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN2O3S/c1-9(2)7-13(20)18-16-19-15(12(23-16)8-14(21)22)10-3-5-11(17)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,21,22)(H,18,19,20)/p-1