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

Systemtic Name: N-[4-[1-[(3-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(3-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[4-[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-(3-chloro-2-methyl-anilino)-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O2S/c1-4-5-9-20(25)23-16-10-12-17(13-11-16)27-15(3)21(26)24-19-8-6-7-18(22)14(19)2/h6-8,10-13,15H,4-5,9H2,1-3H3,(H,23,25)(H,24,26)