1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-benzylsulfanyl-ethanone CAS Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-benzylsulfanylethanone Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)piperidino]-2-(benzylthio)ethanone Formula: C21H22N2O2S MolecularWeight: 366.47658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C21H22N2O2S/c24-20(15-26-14-16-6-2-1-3-7-16)23-12-10-17(11-13-23)21-22-18-8-4-5-9-19(18)25-21/h1-9,17H,10-15H2