2,2,2-tris(fluoranyl)ethyl 5-[[5-(2-adamantyl)-1,3-thiazol-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 5-[[5-(2-adamantyl)-1,3-thiazol-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 2,2,2-trifluoroethyl 5-[[5-(2-adamantyl)thiazol-2-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[5-(2-adamantyl)-2-thiazolyl]amino]-5-oxopentanoic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 5-[[5-(2-adamantyl)-1,3-thiazol-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[5-(2-adamantyl)thiazol-2-yl]amino]-5-keto-valeric acid 2,2,2-trifluoroethyl ester Formula: C20H25F3N2O3S MolecularWeight: 430.48431

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C4=CN=C(S4)NC(=O)CCCC(=O)OCC(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C4=CN=C(S4)NC(=O)CCCC(=O)OCC(F)(F)F

InChI

InChI=1S/C20H25F3N2O3S/c21-20(22,23)10-28-17(27)3-1-2-16(26)25-19-24-9-15(29-19)18-13-5-11-4-12(7-13)8-14(18)6-11/h9,11-14,18H,1-8,10H2,(H,24,25,26)