S-[5-(trifluoromethyl)pyridin-2-yl] 4-methylbenzenecarbothioate

Systemtic Name: S-[5-(trifluoromethyl)pyridin-2-yl] 4-methylbenzenecarbothioate Openeye Name: S-[5-(trifluoromethyl)-2-pyridyl] 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-[5-(trifluoromethyl)-2-pyridinyl] ester IUPAC Name: S-[5-(trifluoromethyl)pyridin-2-yl] 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-[5-(trifluoromethyl)-2-pyridyl] ester Formula: C14H10F3NOS MolecularWeight: 297.29551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)SC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)SC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H10F3NOS/c1-9-2-4-10(5-3-9)13(19)20-12-7-6-11(8-18-12)14(15,16)17/h2-8H,1H3