ethyl 4,5-dimethyl-2-[2-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-(2-oxo-5-pyrrolidin-1-ylsulfonyl-1-pyridyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-[2-oxo-5-(1-pyrrolidinylsulfonyl)-1-pyridinyl]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(2-oxo-5-pyrrolidin-1-ylsulfonylpyridin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(2-keto-5-pyrrolidinosulfonyl-1-pyridyl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C=C(C=CC2=O)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C=C(C=CC2=O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H25N3O6S2/c1-4-29-20(26)18-13(2)14(3)30-19(18)21-16(24)12-22-11-15(7-8-17(22)25)31(27,28)23-9-5-6-10-23/h7-8,11H,4-6,9-10,12H2,1-3H3,(H,21,24)