N-[[4-(ethoxymethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-[[4-(ethoxymethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[[4-(ethoxymethyl)phenyl]methyl]-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[[4-(ethoxymethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[[4-(ethoxymethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[4-(ethoxymethyl)benzyl]-4-(methylthio)-2-(tosylamino)butyramide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)CNC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOCC1=CC=C(C=C1)CNC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H30N2O4S2/c1-4-28-16-19-9-7-18(8-10-19)15-23-22(25)21(13-14-29-3)24-30(26,27)20-11-5-17(2)6-12-20/h5-12,21,24H,4,13-16H2,1-3H3,(H,23,25)