S-pyridin-2-yl 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate

Systemtic Name: S-pyridin-2-yl 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate Openeye Name: S-(2-pyridyl) 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate CAS Name: 1-phenyl-5-(trifluoromethyl)-4-pyrazolecarbothioic acid S-(2-pyridinyl) ester IUPAC Name: S-pyridin-2-yl 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate Traditional Name: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioic acid S-(2-pyridyl) ester Formula: C16H10F3N3OS MolecularWeight: 349.33031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)SC3=CC=CC=N3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)SC3=CC=CC=N3)C(F)(F)F

InChI

InChI=1S/C16H10F3N3OS/c17-16(18,19)14-12(15(23)24-13-8-4-5-9-20-13)10-21-22(14)11-6-2-1-3-7-11/h1-10H