methyl 4-[2-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[4-(4-bromophenyl)thiazol-2-yl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[4-(4-bromophenyl)-2-thiazolyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[[4-(4-bromophenyl)thiazol-2-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C19H15BrN2O3S2 MolecularWeight: 463.368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H15BrN2O3S2/c1-25-18(24)13-4-8-15(9-5-13)21-17(23)11-27-19-22-16(10-26-19)12-2-6-14(20)7-3-12/h2-10H,11H2,1H3,(H,21,23)