3-[methyl-(phenylmethyl)sulfonyl-amino]propanethioamide

Systemtic Name: 3-[methyl-(phenylmethyl)sulfonyl-amino]propanethioamide Openeye Name: 3-[benzylsulfonyl(methyl)amino]propanethioamide CAS Name: 3-[methyl-(phenylmethyl)sulfonylamino]propanethioamide IUPAC Name: 3-[benzylsulfonyl(methyl)amino]propanethioamide Traditional Name: 3-[benzylsulfonyl(methyl)amino]thiopropionamide Formula: C11H16N2O2S2 MolecularWeight: 272.38694

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)S(=O)(=O)CC1=CC=CC=C1

Isomeric SMILES

CN(CCC(=S)N)S(=O)(=O)CC1=CC=CC=C1

InChI

InChI=1S/C11H16N2O2S2/c1-13(8-7-11(12)16)17(14,15)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,12,16)