ethyl 4-cyclopropyl-2-[2-(3-methylsulfonylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-cyclopropyl-2-[2-(3-methylsulfonylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-cyclopropyl-2-[[2-(3-methylsulfonylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4-cyclopropyl-2-[[2-[(3-methylsulfonylphenyl)-oxomethoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyclopropyl-2-[[2-(3-methylsulfonylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-cyclopropyl-2-[[2-(3-mesylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H21NO7S2 MolecularWeight: 451.51324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)COC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)COC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H21NO7S2/c1-3-27-20(24)17-15(12-7-8-12)11-29-18(17)21-16(22)10-28-19(23)13-5-4-6-14(9-13)30(2,25)26/h4-6,9,11-12H,3,7-8,10H2,1-2H3,(H,21,22)