3-[(2-cyclohexylsulfanylpyridin-3-yl)methyl]-2-oxidanyl-6-phenyl-pyran-4-one

Systemtic Name: 3-[(2-cyclohexylsulfanylpyridin-3-yl)methyl]-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-[(2-cyclohexylsulfanyl-3-pyridyl)methyl]-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[[2-(cyclohexylthio)-3-pyridinyl]methyl]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-[(2-cyclohexylsulfanylpyridin-3-yl)methyl]-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[[2-(cyclohexylthio)-3-pyridyl]methyl]-2-hydroxy-6-phenyl-pyran-4-one Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C=CC=N2)CC3=C(OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

C1CCC(CC1)SC2=C(C=CC=N2)CC3=C(OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C23H23NO3S/c25-20-15-21(16-8-3-1-4-9-16)27-23(26)19(20)14-17-10-7-13-24-22(17)28-18-11-5-2-6-12-18/h1,3-4,7-10,13,15,18,26H,2,5-6,11-12,14H2