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

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H20BrN3O6S2 MolecularWeight: 518.4019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C18H20BrN3O6S2/c1-11(2)9-20-18(25)21-15(23)10-28-17(24)12-5-3-4-6-13(12)22-30(26,27)16-8-7-14(19)29-16/h3-8,11,22H,9-10H2,1-2H3,(H2,20,21,23,25)