3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]sulfanylphenol

Systemtic Name: 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]sulfanylphenol Openeye Name: 3-[[3-[3-(4-pyridyl)propoxy]-2-pyridyl]sulfanyl]phenol CAS Name: 3-[[3-(3-pyridin-4-ylpropoxy)-2-pyridinyl]thio]phenol IUPAC Name: 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]sulfanylphenol Traditional Name: 3-[[3-[3-(4-pyridyl)propoxy]-2-pyridyl]thio]phenol Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(C=CC=N2)OCCCC3=CC=NC=C3)O

Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(C=CC=N2)OCCCC3=CC=NC=C3)O

InChI

InChI=1S/C19H18N2O2S/c22-16-5-1-6-17(14-16)24-19-18(7-2-10-21-19)23-13-3-4-15-8-11-20-12-9-15/h1-2,5-12,14,22H,3-4,13H2