N-[(4-pentoxyphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-[(4-pentoxyphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-[(4-pentoxyphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[(4-pentoxyanilino)-sulfanylidenemethyl]-6-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-[(4-pentoxyphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-6-(trifluoromethyl)nicotinamide Formula: C19H20F3N3O2S MolecularWeight: 411.44121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CN=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CN=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H20F3N3O2S/c1-2-3-4-11-27-15-8-6-14(7-9-15)24-18(28)25-17(26)13-5-10-16(23-12-13)19(20,21)22/h5-10,12H,2-4,11H2,1H3,(H2,24,25,26,28)