N-[4-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(2-ethyl-6-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[4-[1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-(2-ethyl-6-methyl-anilino)-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C23H30N2O2S MolecularWeight: 398.5615

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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=C2CC)C

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SC(C)C(=O)NC2=C(C=CC=C2CC)C

InChI

InChI=1S/C23H30N2O2S/c1-5-7-11-21(26)24-19-12-14-20(15-13-19)28-17(4)23(27)25-22-16(3)9-8-10-18(22)6-2/h8-10,12-15,17H,5-7,11H2,1-4H3,(H,24,26)(H,25,27)