2-pyridin-3-ylsulfanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol

Systemtic Name: 2-pyridin-3-ylsulfanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol Openeye Name: 2-(3-pyridylsulfanyl)-6-(2-quinolylmethoxy)chroman-4-ol CAS Name: 2-(3-pyridinylthio)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: 2-pyridin-3-ylsulfanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol Traditional Name: 2-(3-pyridylthio)-6-(2-quinolylmethoxy)chroman-4-ol Formula: C24H20N2O3S MolecularWeight: 416.4922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)OC1SC5=CN=CC=C5)O

Isomeric SMILES

C1C(C2=C(C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)OC1SC5=CN=CC=C5)O

InChI

InChI=1S/C24H20N2O3S/c27-22-13-24(30-19-5-3-11-25-14-19)29-23-10-9-18(12-20(22)23)28-15-17-8-7-16-4-1-2-6-21(16)26-17/h1-12,14,22,24,27H,13,15H2