[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-(methylsulfamoyl)benzoate

Systemtic Name: [2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-(methylsulfamoyl)benzoate Openeye Name: [2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl] 2-bromo-5-(methylsulfamoyl)benzoate CAS Name: 2-bromo-5-(methylsulfamoyl)benzoic acid [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] 2-bromo-5-(methylsulfamoyl)benzoate Traditional Name: 2-bromo-5-(methylsulfamoyl)benzoic acid [2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl] ester Formula: C14H19BrN2O5S MolecularWeight: 407.28006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC)Br

Isomeric SMILES

CC[C@H](C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC)Br

InChI

InChI=1S/C14H19BrN2O5S/c1-4-9(2)17-13(18)8-22-14(19)11-7-10(5-6-12(11)15)23(20,21)16-3/h5-7,9,16H,4,8H2,1-3H3,(H,17,18)/t9-/m0/s1