Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L3US4M
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| Ligand Name |
{4-[2-(2-Hydroxyethoxy)phenyl]piperazin-1-Yl}[(2r,3s)-2-Propyl-1-{[4-(Trifluoromethyl)pyridin-3-Yl]carbonyl}-3-{[5-(Trifluoromethyl)thiophen-3-Yl]oxy}piperidin-3-Yl]methanone
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| Synonyms |
{4-[2-(2-Hydroxyethoxy)phenyl]piperazin-1-Yl}[(2r,3s)-2-Propyl-1-{[4-(Trifluoromethyl)pyridin-3-Yl]carbonyl}-3-{[5-(Trifluoromethyl)thiophen-3-Yl]oxy}piperidin-3-Yl]methanone; SCHEMBL8141427; Q27456184; 62T
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| Structure |
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Download2D MOL |
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| Formula |
C33H36F6N4O5S
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| Canonical SMILES |
CCCC1C(CCCN1C(=O)C2=C(C=CN=C2)C(F)(F)F)(C(=O)N3CCN(CC3)C4=CC=CC=C4OCCO)OC5=CSC(=C5)C(F)(F)F
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| InChI |
1S/C33H36F6N4O5S/c1-2-6-27-31(48-22-19-28(49-21-22)33(37,38)39,10-5-12-43(27)29(45)23-20-40-11-9-24(23)32(34,35)36)30(46)42-15-13-41(14-16-42)25-7-3-4-8-26(25)47-18-17-44/h3-4,7-9,11,19-21,27,44H,2,5-6,10,12-18H2,1H3/t27-,31+/m1/s1
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| InChIKey |
KEKDAGVCTZPOAA-JOMNFKBKSA-N
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| PubChem Compound ID | ||||
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