3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-[(3,4-dimethylphenyl)thio]ethyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-[(3,4-dimethylphenyl)thio]ethyl]propionamide Formula: C21H25NO5S2 MolecularWeight: 435.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C21H25NO5S2/c1-15-3-4-17(13-16(15)2)28-11-8-22-21(23)7-12-29(24,25)18-5-6-19-20(14-18)27-10-9-26-19/h3-6,13-14H,7-12H2,1-2H3,(H,22,23)