Name | Liranaftate Impurity 33 |
Synonyms | N-[6-(dimethylamino)-2-pyridinyl]-N-methylcarbamothioic acid O-(5,6,7,8-tetrahydronaphthalen-2-yl) ester |
CAS | 88678-86-8 |
InChI | InChI=1S/C18H21N3O2/c1-2-23-18(22)19-17-20(15-9-5-3-6-10-15)13-14-21(17)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,19,22) |
InChIKey | CTKWGTDUKXAJAO-UHFFFAOYSA-N |
Canonical Smiles | CCOC(=O)NC1N(CCN1C2=CC=CC=C2)C3=CC=CC=C3 |
Isomers Smiles | CCOC(=O)NC1N(CCN1C2=CC=CC=C2)C3=CC=CC=C3 |
Molecular Formula | C18H21N3O2 |
Molar Mass | 341.5 |
PSA | 60.69000 |
logP | 3.82650 |