3-(phenylmethyl)-6-quinolin-2-yloxy-3,4-dihydro-2H-thiochromen-4-ol

Systemtic Name: 3-(phenylmethyl)-6-quinolin-2-yloxy-3,4-dihydro-2H-thiochromen-4-ol Openeye Name: 3-benzyl-6-(2-quinolyloxy)thiochroman-4-ol CAS Name: 3-(phenylmethyl)-6-(2-quinolinyloxy)-3,4-dihydro-2H-1-benzothiopyran-4-ol IUPAC Name: 3-benzyl-6-quinolin-2-yloxy-3,4-dihydro-2H-thiochromen-4-ol Traditional Name: 3-benzyl-6-(2-quinolyloxy)thiochroman-4-ol Formula: C25H21NO2S MolecularWeight: 399.50474

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=C(S1)C=CC(=C2)OC3=NC4=CC=CC=C4C=C3)O)CC5=CC=CC=C5

Isomeric SMILES

C1C(C(C2=C(S1)C=CC(=C2)OC3=NC4=CC=CC=C4C=C3)O)CC5=CC=CC=C5

InChI

InChI=1S/C25H21NO2S/c27-25-19(14-17-6-2-1-3-7-17)16-29-23-12-11-20(15-21(23)25)28-24-13-10-18-8-4-5-9-22(18)26-24/h1-13,15,19,25,27H,14,16H2