4-[(5-bromanylthiophen-2-yl)sulfonylamino]-3-methyl-benzoate

Systemtic Name: 4-[(5-bromanylthiophen-2-yl)sulfonylamino]-3-methyl-benzoate Openeye Name: 4-[(5-bromo-2-thienyl)sulfonylamino]-3-methyl-benzoate CAS Name: 4-[(5-bromo-2-thiophenyl)sulfonylamino]-3-methylbenzoate IUPAC Name: 4-[(5-bromothiophen-2-yl)sulfonylamino]-3-methylbenzoate Traditional Name: 4-[(5-bromo-2-thienyl)sulfonylamino]-3-methyl-benzoate Formula: C12H9BrNO4S2- MolecularWeight: 375.23816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])NS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])NS(=O)(=O)C2=CC=C(S2)Br

InChI

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