N-[(4-pentoxyphenyl)carbamothioyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[(4-pentoxyphenyl)carbamothioyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[(4-pentoxyphenyl)carbamothioyl]-4-(trifluoromethyl)benzamide CAS Name: N-[(4-pentoxyanilino)-sulfanylidenemethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[(4-pentoxyphenyl)carbamothioyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-4-(trifluoromethyl)benzamide Formula: C20H21F3N2O2S MolecularWeight: 410.45315

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21F3N2O2S/c1-2-3-4-13-27-17-11-9-16(10-12-17)24-19(28)25-18(26)14-5-7-15(8-6-14)20(21,22)23/h5-12H,2-4,13H2,1H3,(H2,24,25,26,28)