diethyl 5-[[5-(4-bromophenyl)sulfonylfuran-2-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[[5-(4-bromophenyl)sulfonylfuran-2-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[5-(4-bromophenyl)sulfonylfuran-2-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[5-(4-bromophenyl)sulfonyl-2-furanyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[5-(4-bromophenyl)sulfonylfuran-2-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(5-brosyl-2-furoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H20BrNO8S2 MolecularWeight: 570.4301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrNO8S2/c1-4-30-21(26)17-12(3)18(22(27)31-5-2)33-20(17)24-19(25)15-10-11-16(32-15)34(28,29)14-8-6-13(23)7-9-14/h6-11H,4-5H2,1-3H3,(H,24,25)