1-(1-adamantyloxy)-3-pyridin-2-ylsulfanyl-propan-2-ol hydrochloride

Systemtic Name: 1-(1-adamantyloxy)-3-pyridin-2-ylsulfanyl-propan-2-ol hydrochloride Openeye Name: 1-(1-adamantyloxy)-3-(2-pyridylsulfanyl)propan-2-ol hydrochloride CAS Name: 1-(1-adamantyloxy)-3-(2-pyridinylthio)-2-propanol hydrochloride IUPAC Name: 1-(1-adamantyloxy)-3-pyridin-2-ylsulfanylpropan-2-ol hydrochloride Traditional Name: 1-(1-adamantyloxy)-3-(2-pyridylthio)propan-2-ol hydrochloride Formula: C18H26ClNO2S MolecularWeight: 355.92254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OCC(CSC4=CC=CC=N4)O.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OCC(CSC4=CC=CC=N4)O.Cl

InChI

InChI=1S/C18H25NO2S.ClH/c20-16(12-22-17-3-1-2-4-19-17)11-21-18-8-13-5-14(9-18)7-15(6-13)10-18;/h1-4,13-16,20H,5-12H2;1H