2-[4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: 2-[4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: 2-[4-(2,5-dimethyl-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: 2-[[4-(2,5-dimethyl-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: 2-[4-(2,5-dimethyl-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: 2-[4-(N-mesyl-2,5-dimethyl-anilino)butanoylamino]benzamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCCC(=O)NC2=CC=CC=C2C(=O)N)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCCC(=O)NC2=CC=CC=C2C(=O)N)S(=O)(=O)C

InChI

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