(2-methylsulfanylphenyl)-[1-(oxan-4-yl)piperidin-3-yl]methanone

Systemtic Name: (2-methylsulfanylphenyl)-[1-(oxan-4-yl)piperidin-3-yl]methanone Openeye Name: (2-methylsulfanylphenyl)-(1-tetrahydropyran-4-yl-3-piperidyl)methanone CAS Name: [2-(methylthio)phenyl]-[1-(4-oxanyl)-3-piperidinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-[1-(oxan-4-yl)piperidin-3-yl]methanone Traditional Name: [2-(methylthio)phenyl]-(1-tetrahydropyran-4-yl-3-piperidyl)methanone Formula: C18H25NO2S MolecularWeight: 319.4616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C3CCOCC3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C3CCOCC3

InChI

InChI=1S/C18H25NO2S/c1-22-17-7-3-2-6-16(17)18(20)14-5-4-10-19(13-14)15-8-11-21-12-9-15/h2-3,6-7,14-15H,4-5,8-13H2,1H3