4-[[methyl-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]methyl]benzamide

Systemtic Name: 4-[[methyl-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]methyl]benzamide Openeye Name: 4-[[methyl-[(2S)-3-methyl-2-(p-tolylsulfonylamino)butanoyl]amino]methyl]benzamide CAS Name: 4-[[methyl-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]amino]methyl]benzamide IUPAC Name: 4-[[methyl-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]methyl]benzamide Traditional Name: 4-[[methyl-[(2S)-3-methyl-2-(tosylamino)butanoyl]amino]methyl]benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)N(C)CC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C21H27N3O4S/c1-14(2)19(23-29(27,28)18-11-5-15(3)6-12-18)21(26)24(4)13-16-7-9-17(10-8-16)20(22)25/h5-12,14,19,23H,13H2,1-4H3,(H2,22,25)/t19-/m0/s1