3-[2-ethylsulfonylethyl(phenyl)amino]propanethioamide

Systemtic Name: 3-[2-ethylsulfonylethyl(phenyl)amino]propanethioamide Openeye Name: 3-[N-(2-ethylsulfonylethyl)anilino]propanethioamide CAS Name: 3-[N-(2-ethylsulfonylethyl)anilino]propanethioamide IUPAC Name: 3-[N-(2-ethylsulfonylethyl)anilino]propanethioamide Traditional Name: 3-[N-(2-esylethyl)anilino]thiopropionamide Formula: C13H20N2O2S2 MolecularWeight: 300.4401

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCN(CCC(=S)N)C1=CC=CC=C1

Isomeric SMILES

CCS(=O)(=O)CCN(CCC(=S)N)C1=CC=CC=C1

InChI

InChI=1S/C13H20N2O2S2/c1-2-19(16,17)11-10-15(9-8-13(14)18)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H2,14,18)