[2-[5-(acetamidomethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[5-(acetamidomethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)sulfonylamino]ethanoate Openeye Name: [2-[5-(acetamidomethyl)-2-thienyl]-2-oxo-ethyl] 2-[(3-bromophenyl)sulfonylamino]acetate CAS Name: 2-[(3-bromophenyl)sulfonylamino]acetic acid [2-[5-(acetamidomethyl)-2-thiophenyl]-2-oxoethyl] ester IUPAC Name: [2-[5-(acetamidomethyl)thiophen-2-yl]-2-oxoethyl] 2-[(3-bromophenyl)sulfonylamino]acetate Traditional Name: 2-[(3-bromophenyl)sulfonylamino]acetic acid [2-[5-(acetamidomethyl)-2-thienyl]-2-keto-ethyl] ester Formula: C17H17BrN2O6S2 MolecularWeight: 489.36068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)C(=O)COC(=O)CNS(=O)(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)C(=O)COC(=O)CNS(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H17BrN2O6S2/c1-11(21)19-8-13-5-6-16(27-13)15(22)10-26-17(23)9-20-28(24,25)14-4-2-3-12(18)7-14/h2-7,20H,8-10H2,1H3,(H,19,21)