2-[4-(4-bromophenyl)-2-(propanoylamino)-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[4-(4-bromophenyl)-2-(propanoylamino)-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[4-(4-bromophenyl)-2-(propanoylamino)thiazol-5-yl]acetate CAS Name: 2-[4-(4-bromophenyl)-2-(1-oxopropylamino)-5-thiazolyl]acetate IUPAC Name: 2-[4-(4-bromophenyl)-2-(propanoylamino)-1,3-thiazol-5-yl]acetate Traditional Name: 2-[4-(4-bromophenyl)-2-propionamido-thiazol-5-yl]acetate Formula: C14H12BrN2O3S- MolecularWeight: 368.22568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O3S/c1-2-11(18)16-14-17-13(10(21-14)7-12(19)20)8-3-5-9(15)6-4-8/h3-6H,2,7H2,1H3,(H,19,20)(H,16,17,18)/p-1