(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C13H9Br2NO3S MolecularWeight: 419.08846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C13H9Br2NO3S/c14-8-6-9(20-11(8)15)13(18)19-10(12(16)17)7-4-2-1-3-5-7/h1-6,10H,(H2,16,17)