2-chloranyl-N-[(4-pentylphenyl)carbamothioyl]-5-(trifluoromethyl)benzamide

Systemtic Name: 2-chloranyl-N-[(4-pentylphenyl)carbamothioyl]-5-(trifluoromethyl)benzamide Openeye Name: 2-chloro-N-[(4-pentylphenyl)carbamothioyl]-5-(trifluoromethyl)benzamide CAS Name: 2-chloro-N-[(4-pentylanilino)-sulfanylidenemethyl]-5-(trifluoromethyl)benzamide IUPAC Name: 2-chloro-N-[(4-pentylphenyl)carbamothioyl]-5-(trifluoromethyl)benzamide Traditional Name: N-[(4-amylphenyl)thiocarbamoyl]-2-chloro-5-(trifluoromethyl)benzamide Formula: C20H20ClF3N2OS MolecularWeight: 428.89881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClF3N2OS/c1-2-3-4-5-13-6-9-15(10-7-13)25-19(28)26-18(27)16-12-14(20(22,23)24)8-11-17(16)21/h6-12H,2-5H2,1H3,(H2,25,26,27,28)