About (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol
(3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol (PubChem CID 159459503) has the molecular formula C209H200F3N3O3S14+14
and a molecular weight of 3307.85 g/mol. Its IUPAC name is (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol.
Analyze (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol with MolForge
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Frequently Asked Questions
What is the IUPAC name of (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol?
The IUPAC name of (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol (CID 159459503) is (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol.
What is the SMILES notation for (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol?
The canonical SMILES for (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol is C[S+](C)c1ccccc1.C[S+](c1ccccc1)c1ccccc1.Cc1cc(C)cc([S+](c2ccccc2)c2ccccc2)c1.FC(F)(F)c1ccc([S+](c2ccccc2)c2ccccc2)cc1.N#Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.N#Cc1cccc([S+](c2ccccc2)c2ccccc2)c1.O=[N+]([O-])c1ccc([S+](c2ccccc2)c2ccccc2)cc1.Oc1ccc([S+]2CCCCC2)c2ccccc12.c1ccc(-[s+]2ccc3ccccc32)cc1.c1ccc([S+]2CCCC2)cc1.c1ccc([S+]2CCCCC2)cc1.c1ccc([S+]2CCc3ccccc32)cc1.c1ccc2c([S+]3CCCC3)cccc2c1.c1ccc2c([S+]3CCCCC3)cccc2c1.
What is the InChIKey of (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol?
The InChIKey is LUKHXANBDOSQMW-UHFFFAOYSA-O. The full InChI is InChI=1S/C20H19S.C19H14F3S.2C19H14NS.C18H14NO2S.C15H16OS.C15H17S.C14H15S.C14H13S.C14H11S.C13H13S.C11H15S.C10H13S.C8H11S/c1-16-13-17(2)15-20(14-16)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19;20-19(21,22)15-11-13-18(14-12-15)23(16-7-3-1-4-8-16)17-9-5-2-6-10-17;20-15-16-8-7-13-19(14-16)21(17-9-3-1-4-10-17)18-11-5-2-6-12-18;20-15-16-11-13-19(14-12-16)21(17-7-3-1-4-8-17)18-9-5-2-6-10-18;20-19(21)15-11-13-18(14-12-15)22(16-7-3-1-4-8-16)17-9-5-2-6-10-17;16-14-8-9-15(17-10-4-1-5-11-17)13-7-3-2-6-12(13)14;1-4-11-16(12-5-1)15-10-6-8-13-7-2-3-9-14(13)15;1-2-8-13-12(6-1)7-5-9-14(13)15-10-3-4-11-15;2*1-2-7-13(8-3-1)15-11-10-12-6-4-5-9-14(12)15;1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6-10(7-3-1)11-8-4-5-9-11;1-9(2)8-6-4-3-5-7-8/h3-15H,1-2H3;1-14H;2*1-14H;1-14H;2-3,6-9H,1,4-5,10-11H2;2-3,6-10H,1,4-5,11-12H2;1-2,5-9H,3-4,10-11H2;1-9H,10-11H2;1-11H;2-11H,1H3;1,3-4,7-8H,2,5-6,9-10H2;1-3,6-7H,4-5,8-9H2;3-7H,1-2H3/q5*+1;;8*+1/p+1.
What are the key properties of (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol?
(3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol has a molecular weight of 3307.85 g/mol, XLogP of 54.95, 26 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyanophenyl)-diphenylsulfanium;(4-cyanophenyl)-diphenylsulfanium;(3,5-dimethylphenyl)-diphenylsulfanium;dimethyl(phenyl)sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;methyl(diphenyl)sulfanium;1-naphthalen-1-ylthian-1-ium;1-naphthalen-1-ylthiolan-1-ium;(4-nitrophenyl)-diphenylsulfanium;1-phenyl-1-benzothiophen-1-ium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium;1-phenylthian-1-ium;1-phenylthiolan-1-ium;4-(thian-1-ium-1-yl)naphthalen-1-ol is sourced from PubChem (CID 159459503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).