ethyl 2-[2-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethoxy]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-chloro-3-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-chloro-3-pyrrolidinosulfonyl-benzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H25ClN2O7S2 MolecularWeight: 577.0689

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C26H25ClN2O7S2/c1-2-35-26(32)23-19(17-8-4-3-5-9-17)16-37-24(23)28-22(30)15-36-25(31)18-10-11-20(27)21(14-18)38(33,34)29-12-6-7-13-29/h3-5,8-11,14,16H,2,6-7,12-13,15H2,1H3,(H,28,30)