N-[4-[1-[[4-chloranyl-2-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[1-[[4-chloranyl-2-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-[4-chloro-2-(trifluoromethyl)anilino]-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[1-[4-chloro-2-(trifluoromethyl)anilino]-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[4-[1-[4-chloro-2-(trifluoromethyl)anilino]-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-[4-chloro-2-(trifluoromethyl)anilino]-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C21H22ClF3N2O2S MolecularWeight: 458.92479

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SC(C)C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SC(C)C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C21H22ClF3N2O2S/c1-3-4-5-19(28)26-15-7-9-16(10-8-15)30-13(2)20(29)27-18-11-6-14(22)12-17(18)21(23,24)25/h6-13H,3-5H2,1-2H3,(H,26,28)(H,27,29)