2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-fluorophenyl)methyl]-4-methylsulfanyl-butanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-fluorophenyl)methyl]-4-methylsulfanyl-butanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-fluorophenyl)methyl]-4-methylsulfanyl-butanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-fluorophenyl)methyl]-4-(methylthio)butanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-fluorophenyl)methyl]-4-methylsulfanylbutanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(4-fluorobenzyl)-4-(methylthio)butyramide Formula: C20H23FN2O5S2 MolecularWeight: 454.535423

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=C(C=C1)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CSCCC(C(=O)NCC1=CC=C(C=C1)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H23FN2O5S2/c1-29-11-8-17(20(24)22-13-14-2-4-15(21)5-3-14)23-30(25,26)16-6-7-18-19(12-16)28-10-9-27-18/h2-7,12,17,23H,8-11,13H2,1H3,(H,22,24)