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

Systemtic Name: N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(4-methylsulfanylphenyl)methyl]butanamide Openeye Name: N-methyl-4-methylsulfanyl-N-[(4-methylsulfanylphenyl)methyl]-2-(p-tolylsulfonylamino)butanamide CAS Name: N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-[[4-(methylthio)phenyl]methyl]butanamide IUPAC Name: N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(4-methylsulfanylphenyl)methyl]butanamide Traditional Name: N-methyl-4-(methylthio)-N-[4-(methylthio)benzyl]-2-(tosylamino)butyramide Formula: C21H28N2O3S3 MolecularWeight: 452.65362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N(C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N(C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C21H28N2O3S3/c1-16-5-11-19(12-6-16)29(25,26)22-20(13-14-27-3)21(24)23(2)15-17-7-9-18(28-4)10-8-17/h5-12,20,22H,13-15H2,1-4H3