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

Systemtic Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[2-(diethylaminomethyl)benzyl]-4-(methylthio)-2-(tosylamino)butyramide Formula: C24H35N3O3S2 MolecularWeight: 477.683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H35N3O3S2/c1-5-27(6-2)18-21-10-8-7-9-20(21)17-25-24(28)23(15-16-31-4)26-32(29,30)22-13-11-19(3)12-14-22/h7-14,23,26H,5-6,15-18H2,1-4H3,(H,25,28)