4-[[2-(4-ethylsulfanylphenyl)-2-methyl-propoxy]methyl]-1-fluoranyl-2-phenoxy-benzene

Systemtic Name: 4-[[2-(4-ethylsulfanylphenyl)-2-methyl-propoxy]methyl]-1-fluoranyl-2-phenoxy-benzene Openeye Name: 4-[[2-(4-ethylsulfanylphenyl)-2-methyl-propoxy]methyl]-1-fluoro-2-phenoxy-benzene CAS Name: 4-[[2-[4-(ethylthio)phenyl]-2-methylpropoxy]methyl]-1-fluoro-2-phenoxybenzene IUPAC Name: 4-[[2-(4-ethylsulfanylphenyl)-2-methylpropoxy]methyl]-1-fluoro-2-phenoxybenzene Traditional Name: 4-[[2-[4-(ethylthio)phenyl]-2-methyl-propoxy]methyl]-1-fluoro-2-phenoxy-benzene Formula: C25H27FO2S MolecularWeight: 410.544083

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(C)(C)COCC2=CC(=C(C=C2)F)OC3=CC=CC=C3

Isomeric SMILES

CCSC1=CC=C(C=C1)C(C)(C)COCC2=CC(=C(C=C2)F)OC3=CC=CC=C3

InChI

InChI=1S/C25H27FO2S/c1-4-29-22-13-11-20(12-14-22)25(2,3)18-27-17-19-10-15-23(26)24(16-19)28-21-8-6-5-7-9-21/h5-16H,4,17-18H2,1-3H3