N-(5-chloranyl-2-phenylsulfanyl-phenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide

Systemtic Name: N-(5-chloranyl-2-phenylsulfanyl-phenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Openeye Name: N-(5-chloro-2-phenylsulfanyl-phenyl)-3-methyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[5-chloro-2-(phenylthio)phenyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: N-(5-chloro-2-phenylsulfanylphenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: N-[5-chloro-2-(phenylthio)phenyl]-3-methyl-2-(tosylamino)butyramide Formula: C24H25ClN2O3S2 MolecularWeight: 489.0499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NC2=C(C=CC(=C2)Cl)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NC2=C(C=CC(=C2)Cl)SC3=CC=CC=C3

InChI

InChI=1S/C24H25ClN2O3S2/c1-16(2)23(27-32(29,30)20-12-9-17(3)10-13-20)24(28)26-21-15-18(25)11-14-22(21)31-19-7-5-4-6-8-19/h4-16,23,27H,1-3H3,(H,26,28)