4-tert-butyl-N-[3-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-(4-methyl-N-methylsulfonyl-anilino)butanoylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(4-methyl-N-methylsulfonylanilino)-1-oxobutyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-(4-methyl-N-methylsulfonylanilino)butanoylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-(N-mesyl-4-methyl-anilino)butanoylamino]phenyl]benzamide Formula: C29H35N3O4S MolecularWeight: 521.6709

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)N(C3=CC=C(C=C3)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)N(C3=CC=C(C=C3)C)S(=O)(=O)C

InChI

InChI=1S/C29H35N3O4S/c1-7-26(32(37(6,35)36)25-17-11-20(2)12-18-25)28(34)31-24-10-8-9-23(19-24)30-27(33)21-13-15-22(16-14-21)29(3,4)5/h8-19,26H,7H2,1-6H3,(H,30,33)(H,31,34)