6-[1-(pyridin-3-ylmethylsulfanyl)propyl]-2,3-dihydro-1-benzofuran-5-ol

Systemtic Name: 6-[1-(pyridin-3-ylmethylsulfanyl)propyl]-2,3-dihydro-1-benzofuran-5-ol Openeye Name: 6-[1-(3-pyridylmethylsulfanyl)propyl]-2,3-dihydrobenzofuran-5-ol CAS Name: 6-[1-(3-pyridinylmethylthio)propyl]-2,3-dihydrobenzofuran-5-ol IUPAC Name: 6-[1-(pyridin-3-ylmethylsulfanyl)propyl]-2,3-dihydro-1-benzofuran-5-ol Traditional Name: 6-[1-(3-pyridylmethylthio)propyl]coumaran-5-ol Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C2CCOC2=C1)O)SCC3=CN=CC=C3

Isomeric SMILES

CCC(C1=C(C=C2CCOC2=C1)O)SCC3=CN=CC=C3

InChI

InChI=1S/C17H19NO2S/c1-2-17(21-11-12-4-3-6-18-10-12)14-9-16-13(5-7-20-16)8-15(14)19/h3-4,6,8-10,17,19H,2,5,7,11H2,1H3