methyl 3-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]benzoate Openeye Name: methyl 3-[(4,5-dibromothiophene-2-carbonyl)amino]benzoate CAS Name: 3-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4,5-dibromothiophene-2-carbonyl)amino]benzoate Traditional Name: 3-[(4,5-dibromothiophene-2-carbonyl)amino]benzoic acid methyl ester Formula: C13H9Br2NO3S MolecularWeight: 419.08846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C13H9Br2NO3S/c1-19-13(18)7-3-2-4-8(5-7)16-12(17)10-6-9(14)11(15)20-10/h2-6H,1H3,(H,16,17)