N-[2-(2-hydroxyethylsulfonyl)ethyl]-3-(4-methoxyphenyl)propanethioamide

Systemtic Name: N-[2-(2-hydroxyethylsulfonyl)ethyl]-3-(4-methoxyphenyl)propanethioamide Openeye Name: N-[2-(2-hydroxyethylsulfonyl)ethyl]-3-(4-methoxyphenyl)propanethioamide CAS Name: N-[2-(2-hydroxyethylsulfonyl)ethyl]-3-(4-methoxyphenyl)propanethioamide IUPAC Name: N-[2-(2-hydroxyethylsulfonyl)ethyl]-3-(4-methoxyphenyl)propanethioamide Traditional Name: N-[2-(2-hydroxyethylsulfonyl)ethyl]-3-(4-methoxyphenyl)thiopropionamide Formula: C14H21NO4S2 MolecularWeight: 331.45084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=S)NCCS(=O)(=O)CCO

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=S)NCCS(=O)(=O)CCO

InChI

InChI=1S/C14H21NO4S2/c1-19-13-5-2-12(3-6-13)4-7-14(20)15-8-10-21(17,18)11-9-16/h2-3,5-6,16H,4,7-11H2,1H3,(H,15,20)