[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C20H17BrN2O5S2 MolecularWeight: 509.39338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C20H17BrN2O5S2/c21-17-10-11-19(29-17)30(26,27)23-16-9-5-4-8-15(16)20(25)28-13-18(24)22-12-14-6-2-1-3-7-14/h1-11,23H,12-13H2,(H,22,24)