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

Systemtic Name: 3-phenylsulfanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol Openeye Name: 3-phenylsulfanyl-6-(2-quinolylmethoxy)chroman-4-ol CAS Name: 3-(phenylthio)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: 3-phenylsulfanyl-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol Traditional Name: 3-(phenylthio)-6-(2-quinolylmethoxy)chroman-4-ol Formula: C25H21NO3S MolecularWeight: 415.50414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=C(O1)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)O)SC5=CC=CC=C5

Isomeric SMILES

C1C(C(C2=C(O1)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)O)SC5=CC=CC=C5

InChI

InChI=1S/C25H21NO3S/c27-25-21-14-19(28-15-18-11-10-17-6-4-5-9-22(17)26-18)12-13-23(21)29-16-24(25)30-20-7-2-1-3-8-20/h1-14,24-25,27H,15-16H2