(3-chloranyl-1-benzothiophen-2-yl)-[(3R)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)-[(3R)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone Openeye Name: (3-chlorobenzothiophen-2-yl)-[(3R)-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone CAS Name: (3-chloro-1-benzothiophen-2-yl)-[(3R)-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone IUPAC Name: (3-chloro-1-benzothiophen-2-yl)-[(3R)-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone Traditional Name: (3-chlorobenzothiophen-2-yl)-[(5R)-5-hydroxy-5-(trifluoromethyl)-3-pyrazolin-1-yl]methanone Formula: C13H8ClF3N2O2S MolecularWeight: 348.72803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)N3C(C=CN3)(C(F)(F)F)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)N3[C@@](C=CN3)(C(F)(F)F)O)Cl

InChI

InChI=1S/C13H8ClF3N2O2S/c14-9-7-3-1-2-4-8(7)22-10(9)11(20)19-12(21,5-6-18-19)13(15,16)17/h1-6,18,21H/t12-/m1/s1