(5-methyl-1,2-oxazol-3-yl)methyl 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C16H13BrN2O5S2 MolecularWeight: 457.31882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=CC(=NO1)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H13BrN2O5S2/c1-10-8-11(18-24-10)9-23-16(20)12-4-2-3-5-13(12)19-26(21,22)15-7-6-14(17)25-15/h2-8,19H,9H2,1H3