N-[4-[1-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[1-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-[2-chloro-5-(trifluoromethyl)anilino]-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[1-[2-chloro-5-(trifluoromethyl)anilino]-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[4-[1-[2-chloro-5-(trifluoromethyl)anilino]-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-[2-chloro-5-(trifluoromethyl)anilino]-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C21H22ClF3N2O2S MolecularWeight: 458.92479

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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