N-[4-[1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(3-chloro-4-fluoro-anilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[4-[1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-(3-chloro-4-fluoro-anilino)-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C20H22ClFN2O2S MolecularWeight: 408.917283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClFN2O2S/c1-3-4-5-19(25)23-14-6-9-16(10-7-14)27-13(2)20(26)24-15-8-11-18(22)17(21)12-15/h6-13H,3-5H2,1-2H3,(H,23,25)(H,24,26)