1-[3-(phenylsulfonyl)-2-propan-2-yl-1,3-diazinan-1-yl]-2-piperidin-1-yl-ethanone

Systemtic Name: 1-[3-(phenylsulfonyl)-2-propan-2-yl-1,3-diazinan-1-yl]-2-piperidin-1-yl-ethanone Openeye Name: 1-[3-(benzenesulfonyl)-2-isopropyl-hexahydropyrimidin-1-yl]-2-(1-piperidyl)ethanone CAS Name: 1-[3-(benzenesulfonyl)-2-propan-2-yl-1,3-diazinan-1-yl]-2-(1-piperidinyl)ethanone IUPAC Name: 1-[3-(benzenesulfonyl)-2-propan-2-yl-1,3-diazinan-1-yl]-2-piperidin-1-ylethanone Traditional Name: 1-(3-besyl-2-isopropyl-hexahydropyrimidin-1-yl)-2-piperidino-ethanone Formula: C20H31N3O3S MolecularWeight: 393.54344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1N(CCCN1S(=O)(=O)C2=CC=CC=C2)C(=O)CN3CCCCC3

Isomeric SMILES

CC(C)C1N(CCCN1S(=O)(=O)C2=CC=CC=C2)C(=O)CN3CCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-17(2)20-22(19(24)16-21-12-7-4-8-13-21)14-9-15-23(20)27(25,26)18-10-5-3-6-11-18/h3,5-6,10-11,17,20H,4,7-9,12-16H2,1-2H3