N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-keto-4-[4-(methylthio)phenyl]butyramide Formula: C21H23NO4S MolecularWeight: 385.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CCC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CCC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H23NO4S/c1-14(16-5-9-19-20(13-16)26-12-11-25-19)22-21(24)10-8-18(23)15-3-6-17(27-2)7-4-15/h3-7,9,13-14H,8,10-12H2,1-2H3,(H,22,24)