N-[2-hydroxyethyl(phenyl)carbamothioyl]-4-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-[2-hydroxyethyl(phenyl)carbamothioyl]-4-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-[2-hydroxyethyl(phenyl)carbamothioyl]-4-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[[N-(2-hydroxyethyl)anilino]-sulfanylidenemethyl]-4-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-[2-hydroxyethyl(phenyl)carbamothioyl]-4-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[2-hydroxyethyl(phenyl)thiocarbamoyl]-4-(trifluoromethyl)nicotinamide Formula: C16H14F3N3O2S MolecularWeight: 369.36147

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCO)C(=S)NC(=O)C2=C(C=CN=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N(CCO)C(=S)NC(=O)C2=C(C=CN=C2)C(F)(F)F

InChI

InChI=1S/C16H14F3N3O2S/c17-16(18,19)13-6-7-20-10-12(13)14(24)21-15(25)22(8-9-23)11-4-2-1-3-5-11/h1-7,10,23H,8-9H2,(H,21,24,25)