[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C18H21BrN2O5S2 MolecularWeight: 489.40374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN2O5S2/c1-3-12(4-2)20-16(22)11-26-18(23)13-7-5-6-8-14(13)21-28(24,25)17-10-9-15(19)27-17/h5-10,12,21H,3-4,11H2,1-2H3,(H,20,22)