3-bromanyl-4-(1,3,4-thiadiazol-2-ylazanidylsulfonyl)benzoate

Systemtic Name: 3-bromanyl-4-(1,3,4-thiadiazol-2-ylazanidylsulfonyl)benzoate Openeye Name: 3-bromo-4-(1,3,4-thiadiazol-2-ylazanidylsulfonyl)benzoate CAS Name: 3-bromo-4-(1,3,4-thiadiazol-2-ylazanidylsulfonyl)benzoate IUPAC Name: 3-bromo-4-(1,3,4-thiadiazol-2-ylazanidylsulfonyl)benzoate Traditional Name: 3-bromo-4-(1,3,4-thiadiazol-2-ylazanidylsulfonyl)benzoate Formula: C9H4BrN3O4S2-2 MolecularWeight: 362.17976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)[O-])Br)S(=O)(=O)[N-]C2=NN=CS2

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[O-])Br)S(=O)(=O)[N-]C2=NN=CS2

InChI

InChI=1S/C9H6BrN3O4S2/c10-6-3-5(8(14)15)1-2-7(6)19(16,17)13-9-12-11-4-18-9/h1-4H,(H2,12,13,14,15)/p-2