(4-methylthiophen-2-yl)-[(5S)-5-oxidanyl-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: (4-methylthiophen-2-yl)-[(5S)-5-oxidanyl-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: [(5S)-5-hydroxy-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methyl-2-thienyl)methanone CAS Name: [(5S)-5-hydroxy-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methyl-2-thiophenyl)methanone IUPAC Name: [(5S)-5-hydroxy-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methylthiophen-2-yl)methanone Traditional Name: [(5S)-5-hydroxy-3-propyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-methyl-2-thienyl)methanone Formula: C13H15F3N2O2S MolecularWeight: 320.33061

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC(=CS2)C

Isomeric SMILES

CCCC1=NN([C@](C1)(C(F)(F)F)O)C(=O)C2=CC(=CS2)C

InChI

InChI=1S/C13H15F3N2O2S/c1-3-4-9-6-12(20,13(14,15)16)18(17-9)11(19)10-5-8(2)7-21-10/h5,7,20H,3-4,6H2,1-2H3/t12-/m0/s1