(2S)-N-butyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-N-butyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-butyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanyl-butanamide CAS Name: (2S)-N-butyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-(methylthio)butanamide IUPAC Name: (2S)-N-butyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanylbutanamide Traditional Name: (2S)-N-butyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-(methylthio)butyramide Formula: C18H28N2O5S2 MolecularWeight: 416.55532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCCCN(C)C(=O)[C@H](CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C18H28N2O5S2/c1-4-5-9-20(2)18(21)15(8-12-26-3)19-27(22,23)14-6-7-16-17(13-14)25-11-10-24-16/h6-7,13,15,19H,4-5,8-12H2,1-3H3/t15-/m0/s1