N-[1-oxidanylidene-1-phenylazanyl-3-(phenylmethylsulfanyl)propan-2-yl]hexanamide

Systemtic Name: N-[1-oxidanylidene-1-phenylazanyl-3-(phenylmethylsulfanyl)propan-2-yl]hexanamide Openeye Name: N-[2-anilino-1-(benzylsulfanylmethyl)-2-oxo-ethyl]hexanamide CAS Name: N-[1-anilino-1-oxo-3-(phenylmethylthio)propan-2-yl]hexanamide IUPAC Name: N-(1-anilino-3-benzylsulfanyl-1-oxopropan-2-yl)hexanamide Traditional Name: N-[2-anilino-1-[(benzylthio)methyl]-2-keto-ethyl]hexanamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O2S/c1-2-3-6-15-21(25)24-20(17-27-16-18-11-7-4-8-12-18)22(26)23-19-13-9-5-10-14-19/h4-5,7-14,20H,2-3,6,15-17H2,1H3,(H,23,26)(H,24,25)