2-[(3-ethoxyphenyl)methylsulfonyl-ethyl-amino]ethanethioamide

Systemtic Name: 2-[(3-ethoxyphenyl)methylsulfonyl-ethyl-amino]ethanethioamide Openeye Name: 2-[(3-ethoxyphenyl)methylsulfonyl-ethyl-amino]thioacetamide CAS Name: 2-[(3-ethoxyphenyl)methylsulfonyl-ethylamino]ethanethioamide IUPAC Name: 2-[(3-ethoxyphenyl)methylsulfonyl-ethylamino]ethanethioamide Traditional Name: 2-[(3-ethoxybenzyl)sulfonyl-ethyl-amino]thioacetamide Formula: C13H20N2O3S2 MolecularWeight: 316.4395

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=S)N)S(=O)(=O)CC1=CC(=CC=C1)OCC

Isomeric SMILES

CCN(CC(=S)N)S(=O)(=O)CC1=CC(=CC=C1)OCC

InChI

InChI=1S/C13H20N2O3S2/c1-3-15(9-13(14)19)20(16,17)10-11-6-5-7-12(8-11)18-4-2/h5-8H,3-4,9-10H2,1-2H3,(H2,14,19)