(2R)-2-[[4-[[(2R)-oxolan-2-yl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]propanamide

Systemtic Name: (2R)-2-[[4-[[(2R)-oxolan-2-yl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]propanamide Openeye Name: (2R)-2-[[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]propanamide CAS Name: (2R)-2-[[4-[[(2R)-2-oxolanyl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]propanamide IUPAC Name: (2R)-2-[[4-[[(2R)-oxolan-2-yl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]propanamide Traditional Name: (2R)-2-[[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]propionamide Formula: C21H21F3N4O3S2 MolecularWeight: 498.54165

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)SC2=NN=C(N2CC3CCCO3)C4=CC=CS4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC(F)(F)F)SC2=NN=C(N2C[C@H]3CCCO3)C4=CC=CS4

InChI

InChI=1S/C21H21F3N4O3S2/c1-13(19(29)25-14-6-8-15(9-7-14)31-21(22,23)24)33-20-27-26-18(17-5-3-11-32-17)28(20)12-16-4-2-10-30-16/h3,5-9,11,13,16H,2,4,10,12H2,1H3,(H,25,29)/t13-,16-/m1/s1