2,2-dimethyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide Openeye Name: 2,2-dimethyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]propanamide CAS Name: 2,2-dimethyl-N-[[5-[4-(methylthio)phenyl]-2,3-dihydrobenzofuran-2-yl]methyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide Traditional Name: 2,2-dimethyl-N-[[5-[4-(methylthio)phenyl]coumaran-2-yl]methyl]propionamide Formula: C21H25NO2S MolecularWeight: 355.4937

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCC1CC2=C(O1)C=CC(=C2)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(C)C(=O)NCC1CC2=C(O1)C=CC(=C2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H25NO2S/c1-21(2,3)20(23)22-13-17-12-16-11-15(7-10-19(16)24-17)14-5-8-18(25-4)9-6-14/h5-11,17H,12-13H2,1-4H3,(H,22,23)