5-[(4-bromophenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: 5-[(4-bromophenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: 5-[(4-bromophenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[(4-bromophenyl)sulfonylamino]-3-methyl-2-thiophenecarboxylate IUPAC Name: 5-[(4-bromophenyl)sulfonylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-(brosylamino)-3-methyl-2-thenoate Formula: C12H9BrNO4S2- MolecularWeight: 375.23816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C12H10BrNO4S2/c1-7-6-10(19-11(7)12(15)16)14-20(17,18)9-4-2-8(13)3-5-9/h2-6,14H,1H3,(H,15,16)/p-1