(2-fluoranyl-5-methyl-phenyl)-[6-(4-methylsulfanylphenyl)-1,3-benzodioxol-5-yl]methanol

Systemtic Name: (2-fluoranyl-5-methyl-phenyl)-[6-(4-methylsulfanylphenyl)-1,3-benzodioxol-5-yl]methanol Openeye Name: (2-fluoro-5-methyl-phenyl)-[6-(4-methylsulfanylphenyl)-1,3-benzodioxol-5-yl]methanol CAS Name: (2-fluoro-5-methylphenyl)-[6-[4-(methylthio)phenyl]-1,3-benzodioxol-5-yl]methanol IUPAC Name: (2-fluoro-5-methylphenyl)-[6-(4-methylsulfanylphenyl)-1,3-benzodioxol-5-yl]methanol Traditional Name: (2-fluoro-5-methyl-phenyl)-[6-[4-(methylthio)phenyl]-1,3-benzodioxol-5-yl]methanol Formula: C22H19FO3S MolecularWeight: 382.447863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)C(C2=CC3=C(C=C2C4=CC=C(C=C4)SC)OCO3)O

Isomeric SMILES

CC1=CC(=C(C=C1)F)C(C2=CC3=C(C=C2C4=CC=C(C=C4)SC)OCO3)O

InChI

InChI=1S/C22H19FO3S/c1-13-3-8-19(23)18(9-13)22(24)17-11-21-20(25-12-26-21)10-16(17)14-4-6-15(27-2)7-5-14/h3-11,22,24H,12H2,1-2H3