2-[2-(4-methoxyphenyl)azepan-1-yl]-N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide

Systemtic Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide Openeye Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-N-(3-methyl-1,1-dioxo-thiolan-3-yl)acetamide CAS Name: 2-[2-(4-methoxyphenyl)-1-azepanyl]-N-(3-methyl-1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide Formula: C20H30N2O4S MolecularWeight: 394.5282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)CN2CCCCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=O)CN2CCCCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H30N2O4S/c1-20(11-13-27(24,25)15-20)21-19(23)14-22-12-5-3-4-6-18(22)16-7-9-17(26-2)10-8-16/h7-10,18H,3-6,11-15H2,1-2H3,(H,21,23)