ethyl 5-(dimethylcarbamoyl)-4-methyl-2-[2-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-(dimethylcarbamoyl)-4-methyl-2-[2-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-(3-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[1-oxo-2-[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-(3-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-[[2-(3-pyrrolidinosulfonylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H29N3O8S2 MolecularWeight: 551.63236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C24H29N3O8S2/c1-5-34-24(31)19-15(2)20(22(29)26(3)4)36-21(19)25-18(28)14-35-23(30)16-9-8-10-17(13-16)37(32,33)27-11-6-7-12-27/h8-10,13H,5-7,11-12,14H2,1-4H3,(H,25,28)