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

Systemtic Name: (2S)-N-(3-cyclohexyloxypropyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-[3-(cyclohexoxy)propyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanyl-butanamide CAS Name: (2S)-N-(3-cyclohexyloxypropyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-(methylthio)butanamide IUPAC Name: (2S)-N-(3-cyclohexyloxypropyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanylbutanamide Traditional Name: (2S)-N-[3-(cyclohexoxy)propyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-(methylthio)butyramide Formula: C22H34N2O6S2 MolecularWeight: 486.64516

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCCOC1CCCCC1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CSCC[C@@H](C(=O)NCCCOC1CCCCC1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C22H34N2O6S2/c1-31-15-10-19(22(25)23-11-5-12-28-17-6-3-2-4-7-17)24-32(26,27)18-8-9-20-21(16-18)30-14-13-29-20/h8-9,16-17,19,24H,2-7,10-15H2,1H3,(H,23,25)/t19-/m0/s1