4-[[2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]benzamide

Systemtic Name: 4-[[2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]benzamide Openeye Name: 4-[[2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]benzamide CAS Name: 4-[[2-[(2,5-dimethylphenyl)sulfonylamino]-4-(methylthio)-1-oxobutyl]amino]benzamide IUPAC Name: 4-[[2-[(2,5-dimethylphenyl)sulfonylamino]-4-methylsulfanylbutanoyl]amino]benzamide Traditional Name: 4-[[2-[(2,5-dimethylphenyl)sulfonylamino]-4-(methylthio)butanoyl]amino]benzamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CCSC)C(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(CCSC)C(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C20H25N3O4S2/c1-13-4-5-14(2)18(12-13)29(26,27)23-17(10-11-28-3)20(25)22-16-8-6-15(7-9-16)19(21)24/h4-9,12,17,23H,10-11H2,1-3H3,(H2,21,24)(H,22,25)