[1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methanethiol

Systemtic Name: [1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methanethiol Openeye Name: [1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methanethiol CAS Name: [1-methyl-5-phenoxy-3-(trifluoromethyl)-4-pyrazolyl]methanethiol IUPAC Name: [1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methanethiol Traditional Name: [1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methanethiol Formula: C12H11F3N2OS MolecularWeight: 288.28875

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)CS)OC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)CS)OC2=CC=CC=C2

InChI

InChI=1S/C12H11F3N2OS/c1-17-11(18-8-5-3-2-4-6-8)9(7-19)10(16-17)12(13,14)15/h2-6,19H,7H2,1H3