3-phenethylsulfanyl-6-[4-(pyridin-2-ylmethoxy)phenyl]pyran-2-one

Systemtic Name: 3-phenethylsulfanyl-6-[4-(pyridin-2-ylmethoxy)phenyl]pyran-2-one Openeye Name: 3-phenethylsulfanyl-6-[4-(2-pyridylmethoxy)phenyl]pyran-2-one CAS Name: 3-(phenethylthio)-6-[4-(2-pyridinylmethoxy)phenyl]-2-pyranone IUPAC Name: 3-phenethylsulfanyl-6-[4-(pyridin-2-ylmethoxy)phenyl]pyran-2-one Traditional Name: 3-(phenethylthio)-6-[4-(2-pyridylmethoxy)phenyl]pyran-2-one Formula: C25H21NO3S MolecularWeight: 415.50414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=CC=C(OC2=O)C3=CC=C(C=C3)OCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=CC=C(OC2=O)C3=CC=C(C=C3)OCC4=CC=CC=N4

InChI

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