methyl 4-[[5-(2-sulfanylethylcarbamoyl)furan-2-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[5-(2-sulfanylethylcarbamoyl)furan-2-yl]methoxy]benzoate Openeye Name: methyl 4-[[5-(2-sulfanylethylcarbamoyl)-2-furyl]methoxy]benzoate CAS Name: 4-[[5-[(2-mercaptoethylamino)-oxomethyl]-2-furanyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-sulfanylethylcarbamoyl)furan-2-yl]methoxy]benzoate Traditional Name: 4-[[5-(2-mercaptoethylcarbamoyl)-2-furyl]methoxy]benzoic acid methyl ester Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NCCS

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NCCS

InChI

InChI=1S/C16H17NO5S/c1-20-16(19)11-2-4-12(5-3-11)21-10-13-6-7-14(22-13)15(18)17-8-9-23/h2-7,23H,8-10H2,1H3,(H,17,18)