(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-[2-[(4-bromophenyl)carbonylamino]ethanoylamino]ethanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-[2-[(4-bromophenyl)carbonylamino]ethanoylamino]ethanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-[[2-[(4-bromobenzoyl)amino]acetyl]amino]acetate CAS Name: 2-[[2-[[(4-bromophenyl)-oxomethyl]amino]-1-oxoethyl]amino]acetic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-[[2-[(4-bromobenzoyl)amino]acetyl]amino]acetate Traditional Name: 2-[[2-[(4-bromobenzoyl)amino]acetyl]amino]acetic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C17H15BrN2O5S MolecularWeight: 439.2804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)COC(=O)CNC(=O)CNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CSC(=C1)C(=O)COC(=O)CNC(=O)CNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H15BrN2O5S/c18-12-5-3-11(4-6-12)17(24)20-8-15(22)19-9-16(23)25-10-13(21)14-2-1-7-26-14/h1-7H,8-10H2,(H,19,22)(H,20,24)