(2S)-N-(3-acetamidophenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide

Systemtic Name: (2S)-N-(3-acetamidophenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Openeye Name: (2S)-N-(3-acetamidophenyl)-3-methyl-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-N-(3-acetamidophenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: (2S)-N-(3-acetamidophenyl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: (2S)-N-(3-acetamidophenyl)-3-methyl-2-(tosylamino)butyramide Formula: C20H25N3O4S MolecularWeight: 403.4952

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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=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NC2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C20H25N3O4S/c1-13(2)19(23-28(26,27)18-10-8-14(3)9-11-18)20(25)22-17-7-5-6-16(12-17)21-15(4)24/h5-13,19,23H,1-4H3,(H,21,24)(H,22,25)/t19-/m0/s1