A8K
Summary
Name: | 4-(4-hydroxyphenyl)sulfanylphenol |
Formula: | C12 H10 O2 S |
Formal charge: | 0 |
Formula weight: | 218.272 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 4-(4-hydroxyphenyl)sulfanylphenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H10O2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,13-14H |
InChIKey | InChI | 1.03 | VWGKEVWFBOUAND-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(Sc2ccc(O)cc2)cc1 |
SMILES | CACTVS | 3.385 | Oc1ccc(Sc2ccc(O)cc2)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1O)Sc2ccc(cc2)O |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1O)Sc2ccc(cc2)O |