N-butyl-2-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: N-butyl-2-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: N-butyl-2-[2-(4-methyl-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-butyl-2-[[2-(4-methyl-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-butyl-2-[2-(4-methyl-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N-butyl-2-[2-(N-mesyl-4-methyl-anilino)butanoylamino]benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C(CC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)C(CC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O4S/c1-5-7-16-24-22(27)19-10-8-9-11-20(19)25-23(28)21(6-2)26(31(4,29)30)18-14-12-17(3)13-15-18/h8-15,21H,5-7,16H2,1-4H3,(H,24,27)(H,25,28)