(2S)-3-methyl-N-(4-methyl-3-sulfamoyl-phenyl)-2-(2-phenylethanoylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-(4-methyl-3-sulfamoyl-phenyl)-2-(2-phenylethanoylamino)butanamide Openeye Name: (2S)-3-methyl-N-(4-methyl-3-sulfamoyl-phenyl)-2-[(2-phenylacetyl)amino]butanamide CAS Name: (2S)-3-methyl-N-(4-methyl-3-sulfamoylphenyl)-2-[(1-oxo-2-phenylethyl)amino]butanamide IUPAC Name: (2S)-3-methyl-N-(4-methyl-3-sulfamoylphenyl)-2-[(2-phenylacetyl)amino]butanamide Traditional Name: (2S)-3-methyl-N-(4-methyl-3-sulfamoyl-phenyl)-2-[(2-phenylacetyl)amino]butyramide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-13(2)19(23-18(24)11-15-7-5-4-6-8-15)20(25)22-16-10-9-14(3)17(12-16)28(21,26)27/h4-10,12-13,19H,11H2,1-3H3,(H,22,25)(H,23,24)(H2,21,26,27)/t19-/m0/s1