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

Systemtic Name: 2-[5-(4-bromophenyl)-4-methyl-1,3-thiazol-2-yl]ethanoate Openeye Name: 2-[5-(4-bromophenyl)-4-methyl-thiazol-2-yl]acetate CAS Name: 2-[5-(4-bromophenyl)-4-methyl-2-thiazolyl]acetate IUPAC Name: 2-[5-(4-bromophenyl)-4-methyl-1,3-thiazol-2-yl]acetate Traditional Name: 2-[5-(4-bromophenyl)-4-methyl-thiazol-2-yl]acetate Formula: C12H9BrNO2S- MolecularWeight: 311.17436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)[O-])C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)[O-])C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H10BrNO2S/c1-7-12(8-2-4-9(13)5-3-8)17-10(14-7)6-11(15)16/h2-5H,6H2,1H3,(H,15,16)/p-1