N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2-(2,4,6-trimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2-(2,4,6-trimethylphenyl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2-(2,4,6-trimethylphenyl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2-[(2,4,6-trimethylphenyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-2-(2,4,6-trimethylphenyl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(mesitylthio)-N-methyl-acetamide Formula: C21H25NO3S MolecularWeight: 371.4931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SCC(=O)N(C)CC2COC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SCC(=O)N(C)CC2COC3=CC=CC=C3O2)C

InChI

InChI=1S/C21H25NO3S/c1-14-9-15(2)21(16(3)10-14)26-13-20(23)22(4)11-17-12-24-18-7-5-6-8-19(18)25-17/h5-10,17H,11-13H2,1-4H3