1-[3-methyl-4-(2-methylpropylsulfanyl)phenyl]-2-piperidin-1-yl-ethanol

Systemtic Name: 1-[3-methyl-4-(2-methylpropylsulfanyl)phenyl]-2-piperidin-1-yl-ethanol Openeye Name: 1-(4-isobutylsulfanyl-3-methyl-phenyl)-2-(1-piperidyl)ethanol CAS Name: 1-[3-methyl-4-(2-methylpropylthio)phenyl]-2-(1-piperidinyl)ethanol IUPAC Name: 1-[3-methyl-4-(2-methylpropylsulfanyl)phenyl]-2-piperidin-1-ylethanol Traditional Name: 1-[4-(isobutylthio)-3-methyl-phenyl]-2-piperidino-ethanol Formula: C18H29NOS MolecularWeight: 307.49396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CN2CCCCC2)O)SCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(CN2CCCCC2)O)SCC(C)C

InChI

InChI=1S/C18H29NOS/c1-14(2)13-21-18-8-7-16(11-15(18)3)17(20)12-19-9-5-4-6-10-19/h7-8,11,14,17,20H,4-6,9-10,12-13H2,1-3H3