S-quinolin-2-yl 3-(trifluoromethyl)benzenecarbothioate

Systemtic Name: S-quinolin-2-yl 3-(trifluoromethyl)benzenecarbothioate Openeye Name: S-(2-quinolyl) 3-(trifluoromethyl)benzenecarbothioate CAS Name: 3-(trifluoromethyl)benzenecarbothioic acid S-(2-quinolinyl) ester IUPAC Name: S-quinolin-2-yl 3-(trifluoromethyl)benzenecarbothioate Traditional Name: 3-(trifluoromethyl)thiobenzoic acid S-(2-quinolyl) ester Formula: C17H10F3NOS MolecularWeight: 333.32761

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H10F3NOS/c18-17(19,20)13-6-3-5-12(10-13)16(22)23-15-9-8-11-4-1-2-7-14(11)21-15/h1-10H