5-methyl-N-[(4-pentylphenyl)carbamothioyl]-2-(trifluoromethyl)furan-3-carboxamide

Systemtic Name: 5-methyl-N-[(4-pentylphenyl)carbamothioyl]-2-(trifluoromethyl)furan-3-carboxamide Openeye Name: 5-methyl-N-[(4-pentylphenyl)carbamothioyl]-2-(trifluoromethyl)furan-3-carboxamide CAS Name: 5-methyl-N-[(4-pentylanilino)-sulfanylidenemethyl]-2-(trifluoromethyl)-3-furancarboxamide IUPAC Name: 5-methyl-N-[(4-pentylphenyl)carbamothioyl]-2-(trifluoromethyl)furan-3-carboxamide Traditional Name: N-[(4-amylphenyl)thiocarbamoyl]-5-methyl-2-(trifluoromethyl)-3-furamide Formula: C19H21F3N2O2S MolecularWeight: 398.44245

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3N2O2S/c1-3-4-5-6-13-7-9-14(10-8-13)23-18(27)24-17(25)15-11-12(2)26-16(15)19(20,21)22/h7-11H,3-6H2,1-2H3,(H2,23,24,25,27)