dimethyl 3-methyl-5-[2-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(4-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methoxy]ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(4-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(4-pyrrolidinosulfonylbenzoyl)oxyacetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H24N2O9S2 MolecularWeight: 524.56396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)OC

InChI

InChI=1S/C22H24N2O9S2/c1-13-17(21(27)31-2)19(34-18(13)22(28)32-3)23-16(25)12-33-20(26)14-6-8-15(9-7-14)35(29,30)24-10-4-5-11-24/h6-9H,4-5,10-12H2,1-3H3,(H,23,25)