(5-azanyl-1-methylsulfonyl-pyrazol-3-yl) 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: (5-azanyl-1-methylsulfonyl-pyrazol-3-yl) 5-bromanyl-2-chloranyl-benzoate Openeye Name: (5-amino-1-methylsulfonyl-pyrazol-3-yl) 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid (5-amino-1-methylsulfonyl-3-pyrazolyl) ester IUPAC Name: (5-amino-1-methylsulfonylpyrazol-3-yl) 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid (5-amino-1-mesyl-pyrazol-3-yl) ester Formula: C11H9BrClN3O4S MolecularWeight: 394.62886

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(=CC(=N1)OC(=O)C2=C(C=CC(=C2)Br)Cl)N

Isomeric SMILES

CS(=O)(=O)N1C(=CC(=N1)OC(=O)C2=C(C=CC(=C2)Br)Cl)N

InChI

InChI=1S/C11H9BrClN3O4S/c1-21(18,19)16-9(14)5-10(15-16)20-11(17)7-4-6(12)2-3-8(7)13/h2-5H,14H2,1H3