N-[3-[1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[3-[1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[3-[2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[3-[[1-(2-ethoxyanilino)-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[3-[1-(2-ethoxyanilino)-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[3-[[2-keto-1-methyl-2-(o-phenetidino)ethyl]thio]phenyl]valeramide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=CC=C2OCC

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=CC=C2OCC

InChI

InChI=1S/C22H28N2O3S/c1-4-6-14-21(25)23-17-10-9-11-18(15-17)28-16(3)22(26)24-19-12-7-8-13-20(19)27-5-2/h7-13,15-16H,4-6,14H2,1-3H3,(H,23,25)(H,24,26)