3-[[4-[4-(2-pyridin-2-ylsulfanylethyl)phenyl]piperidin-3-yl]oxymethyl]naphthalen-1-ol

Systemtic Name: 3-[[4-[4-(2-pyridin-2-ylsulfanylethyl)phenyl]piperidin-3-yl]oxymethyl]naphthalen-1-ol Openeye Name: 3-[[4-[4-[2-(2-pyridylsulfanyl)ethyl]phenyl]-3-piperidyl]oxymethyl]naphthalen-1-ol CAS Name: 3-[[4-[4-[2-(2-pyridinylthio)ethyl]phenyl]-3-piperidinyl]oxymethyl]-1-naphthalenol IUPAC Name: 3-[[4-[4-(2-pyridin-2-ylsulfanylethyl)phenyl]piperidin-3-yl]oxymethyl]naphthalen-1-ol Traditional Name: 3-[[4-[4-[2-(2-pyridylthio)ethyl]phenyl]-3-piperidyl]oxymethyl]-1-naphthol Formula: C29H30N2O2S MolecularWeight: 470.6257

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=C(C=C2)CCSC3=CC=CC=N3)OCC4=CC5=CC=CC=C5C(=C4)O

Isomeric SMILES

C1CNCC(C1C2=CC=C(C=C2)CCSC3=CC=CC=N3)OCC4=CC5=CC=CC=C5C(=C4)O

InChI

InChI=1S/C29H30N2O2S/c32-27-18-22(17-24-5-1-2-6-25(24)27)20-33-28-19-30-15-12-26(28)23-10-8-21(9-11-23)13-16-34-29-7-3-4-14-31-29/h1-11,14,17-18,26,28,30,32H,12-13,15-16,19-20H2