5-(5-fluoranyl-2-methyl-phenyl)azanidylsulfonylthiophene-3-carboxylate

Systemtic Name: 5-(5-fluoranyl-2-methyl-phenyl)azanidylsulfonylthiophene-3-carboxylate Openeye Name: 5-(5-fluoro-2-methyl-phenyl)azanidylsulfonylthiophene-3-carboxylate CAS Name: 5-(5-fluoro-2-methylphenyl)azanidylsulfonyl-3-thiophenecarboxylate IUPAC Name: 5-(5-fluoro-2-methylphenyl)azanidylsulfonylthiophene-3-carboxylate Traditional Name: 5-(5-fluoro-2-methyl-phenyl)azanidylsulfonyl-3-thenoate Formula: C12H8FNO4S2-2 MolecularWeight: 313.324623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)[N-]S(=O)(=O)C2=CC(=CS2)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)F)[N-]S(=O)(=O)C2=CC(=CS2)C(=O)[O-]

InChI

InChI=1S/C12H9FNO4S2/c1-7-2-3-9(13)5-10(7)14-20(17,18)11-4-8(6-19-11)12(15)16/h2-6H,1H3,(H,15,16)/q-1/p-1