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

Systemtic Name: diethyl 3-methyl-5-[[5-(phenylsulfonyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[5-(benzenesulfonyl)furan-2-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[5-(benzenesulfonyl)-2-furanyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[5-(benzenesulfonyl)furan-2-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(5-besyl-2-furoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H21NO8S2 MolecularWeight: 491.53404

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H21NO8S2/c1-4-29-21(25)17-13(3)18(22(26)30-5-2)32-20(17)23-19(24)15-11-12-16(31-15)33(27,28)14-9-7-6-8-10-14/h6-12H,4-5H2,1-3H3,(H,23,24)