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

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanyl-butanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanyl-butanamide CAS Name: N-[(2-chlorophenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-(methylthio)butanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-methylsulfanylbutanamide Traditional Name: N-(2-chlorobenzyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methyl-4-(methylthio)butyramide Formula: C21H25ClN2O5S2 MolecularWeight: 485.0166

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Cl)C(=O)C(CCSC)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CN(CC1=CC=CC=C1Cl)C(=O)C(CCSC)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H25ClN2O5S2/c1-24(14-15-5-3-4-6-17(15)22)21(25)18(9-12-30-2)23-31(26,27)16-7-8-19-20(13-16)29-11-10-28-19/h3-8,13,18,23H,9-12,14H2,1-2H3