1-[4-(2-methylphenyl)-4-oxidanyl-piperidin-1-yl]-2,2-dithiophen-2-yl-ethanone

Systemtic Name: 1-[4-(2-methylphenyl)-4-oxidanyl-piperidin-1-yl]-2,2-dithiophen-2-yl-ethanone Openeye Name: 1-[4-hydroxy-4-(o-tolyl)-1-piperidyl]-2,2-bis(2-thienyl)ethanone CAS Name: 1-[4-hydroxy-4-(2-methylphenyl)-1-piperidinyl]-2,2-dithiophen-2-ylethanone IUPAC Name: 1-[4-hydroxy-4-(2-methylphenyl)piperidin-1-yl]-2,2-dithiophen-2-ylethanone Traditional Name: 1-[4-hydroxy-4-(o-tolyl)piperidino]-2,2-bis(2-thienyl)ethanone Formula: C22H23NO2S2 MolecularWeight: 397.55352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2(CCN(CC2)C(=O)C(C3=CC=CS3)C4=CC=CS4)O

Isomeric SMILES

CC1=CC=CC=C1C2(CCN(CC2)C(=O)C(C3=CC=CS3)C4=CC=CS4)O

InChI

InChI=1S/C22H23NO2S2/c1-16-6-2-3-7-17(16)22(25)10-12-23(13-11-22)21(24)20(18-8-4-14-26-18)19-9-5-15-27-19/h2-9,14-15,20,25H,10-13H2,1H3