N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4,5-dimethoxy-2-methylphenyl)methylthio]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4,5-dimethoxy-2-methyl-benzyl)thio]propionamide Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSCCC(=O)NC2=CC3=C(C=C2)OCCO3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSCCC(=O)NC2=CC3=C(C=C2)OCCO3)OC)OC

InChI

InChI=1S/C21H25NO5S/c1-14-10-18(24-2)19(25-3)11-15(14)13-28-9-6-21(23)22-16-4-5-17-20(12-16)27-8-7-26-17/h4-5,10-12H,6-9,13H2,1-3H3,(H,22,23)