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

Systemtic Name: N-[(4-pentylphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-[(4-pentylphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[(4-pentylanilino)-sulfanylidenemethyl]-6-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-[(4-pentylphenyl)carbamothioyl]-6-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[(4-amylphenyl)thiocarbamoyl]-6-(trifluoromethyl)nicotinamide Formula: C19H20F3N3OS MolecularWeight: 395.44181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CN=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CN=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H20F3N3OS/c1-2-3-4-5-13-6-9-15(10-7-13)24-18(27)25-17(26)14-8-11-16(23-12-14)19(20,21)22/h6-12H,2-5H2,1H3,(H2,24,25,26,27)