N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-(methylsulfanylmethyl)benzamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-(methylsulfanylmethyl)benzamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-(methylsulfanylmethyl)benzamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-[(methylthio)methyl]benzamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-(methylsulfanylmethyl)benzamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-[(methylthio)methyl]benzamide Formula: C20H23NO3S MolecularWeight: 357.46652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC=C(C=C3)CSC

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC=C(C=C3)CSC

InChI

InChI=1S/C20H23NO3S/c1-14(17-8-9-18-19(12-17)24-11-3-10-23-18)21-20(22)16-6-4-15(5-7-16)13-25-2/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,21,22)