S-[3-(trifluoromethyl)pyridin-2-yl] 4-chloranylbenzenecarbothioate

Systemtic Name: S-[3-(trifluoromethyl)pyridin-2-yl] 4-chloranylbenzenecarbothioate Openeye Name: S-[3-(trifluoromethyl)-2-pyridyl] 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-[3-(trifluoromethyl)-2-pyridinyl] ester IUPAC Name: S-[3-(trifluoromethyl)pyridin-2-yl] 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-[3-(trifluoromethyl)-2-pyridyl] ester Formula: C13H7ClF3NOS MolecularWeight: 317.71399

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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