N-[2-(diethylamino)-3-methyl-butyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-[2-(diethylamino)-3-methyl-butyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[2-(diethylamino)-3-methyl-butyl]-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[2-(diethylamino)-3-methylbutyl]-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[2-(diethylamino)-3-methylbutyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[2-(diethylamino)-3-methyl-butyl]-4-(methylthio)-2-(tosylamino)butyramide Formula: C21H37N3O3S2 MolecularWeight: 443.66678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)C)C(C)C

Isomeric SMILES

CCN(CC)C(CNC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)C)C(C)C

InChI

InChI=1S/C21H37N3O3S2/c1-7-24(8-2)20(16(3)4)15-22-21(25)19(13-14-28-6)23-29(26,27)18-11-9-17(5)10-12-18/h9-12,16,19-20,23H,7-8,13-15H2,1-6H3,(H,22,25)