S-[3-(trifluoromethyl)phenyl] 2-chloranylpyridine-4-carbothioate

Systemtic Name: S-[3-(trifluoromethyl)phenyl] 2-chloranylpyridine-4-carbothioate Openeye Name: S-[3-(trifluoromethyl)phenyl] 2-chloropyridine-4-carbothioate CAS Name: 2-chloro-4-pyridinecarbothioic acid S-[3-(trifluoromethyl)phenyl] ester IUPAC Name: S-[3-(trifluoromethyl)phenyl] 2-chloropyridine-4-carbothioate Traditional Name: 2-chloropyridine-4-carbothioic acid S-[3-(trifluoromethyl)phenyl] ester Formula: C13H7ClF3NOS MolecularWeight: 317.71399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC(=O)C2=CC(=NC=C2)Cl)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SC(=O)C2=CC(=NC=C2)Cl)C(F)(F)F

InChI

InChI=1S/C13H7ClF3NOS/c14-11-6-8(4-5-18-11)12(19)20-10-3-1-2-9(7-10)13(15,16)17/h1-7H