methyl 2-methyl-5-[[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]sulfanylmethyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]sulfanylmethyl]furan-3-carboxylate Traditional Name: 5-[[[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C20H24N2O6S2 MolecularWeight: 452.54436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C(=O)OC

InChI

InChI=1S/C20H24N2O6S2/c1-14-18(20(24)27-2)11-16(28-14)12-29-13-19(23)21-15-6-5-7-17(10-15)30(25,26)22-8-3-4-9-22/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3,(H,21,23)