3-bromanyl-4-pyrimidin-2-ylazanidylsulfonyl-benzoate

Systemtic Name: 3-bromanyl-4-pyrimidin-2-ylazanidylsulfonyl-benzoate Openeye Name: 3-bromo-4-pyrimidin-2-ylazanidylsulfonyl-benzoate CAS Name: 3-bromo-4-(2-pyrimidinylazanidylsulfonyl)benzoate IUPAC Name: 3-bromo-4-pyrimidin-2-ylazanidylsulfonylbenzoate Traditional Name: 3-bromo-4-(2-pyrimidylazanidylsulfonyl)benzoate Formula: C11H6BrN3O4S-2 MolecularWeight: 356.15204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)[N-]S(=O)(=O)C2=C(C=C(C=C2)C(=O)[O-])Br

Isomeric SMILES

C1=CN=C(N=C1)[N-]S(=O)(=O)C2=C(C=C(C=C2)C(=O)[O-])Br

InChI

InChI=1S/C11H8BrN3O4S/c12-8-6-7(10(16)17)2-3-9(8)20(18,19)15-11-13-4-1-5-14-11/h1-6H,(H2,13,14,15,16,17)/p-2