5-methoxy-1-(pyridin-3-ylmethylsulfanyl)isoquinoline

Systemtic Name: 5-methoxy-1-(pyridin-3-ylmethylsulfanyl)isoquinoline Openeye Name: 5-methoxy-1-(3-pyridylmethylsulfanyl)isoquinoline CAS Name: 5-methoxy-1-(3-pyridinylmethylthio)isoquinoline IUPAC Name: 5-methoxy-1-(pyridin-3-ylmethylsulfanyl)isoquinoline Traditional Name: 5-methoxy-1-(3-pyridylmethylthio)isoquinoline Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=CN=C2SCC3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC2=C1C=CN=C2SCC3=CN=CC=C3

InChI

InChI=1S/C16H14N2OS/c1-19-15-6-2-5-14-13(15)7-9-18-16(14)20-11-12-4-3-8-17-10-12/h2-10H,11H2,1H3