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

Systemtic Name: methyl 2-[(5-bromanylthiophen-2-yl)sulfonylamino]-5-methyl-benzoate Openeye Name: methyl 2-[(5-bromo-2-thienyl)sulfonylamino]-5-methyl-benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[(5-bromothiophen-2-yl)sulfonylamino]-5-methylbenzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]-5-methyl-benzoic acid methyl ester Formula: C13H12BrNO4S2 MolecularWeight: 390.27268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(S2)Br)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(S2)Br)C(=O)OC

InChI

InChI=1S/C13H12BrNO4S2/c1-8-3-4-10(9(7-8)13(16)19-2)15-21(17,18)12-6-5-11(14)20-12/h3-7,15H,1-2H3