O4-ethyl O2-methyl 3-methyl-5-[2-(phenylsulfonyl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 3-methyl-5-[2-(phenylsulfonyl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-[[2-(benzenesulfonyl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(benzenesulfonyl)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 5-[[2-(benzenesulfonyl)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(2-besylacetyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C18H19NO7S2 MolecularWeight: 425.47596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO7S2/c1-4-26-17(21)14-11(2)15(18(22)25-3)27-16(14)19-13(20)10-28(23,24)12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3,(H,19,20)