4-tert-butyl-N-[3-[2-[(2,4-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[(2,4-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(2,4-dimethyl-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(2,4-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(2,4-dimethyl-N-methylsulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(N-mesyl-2,4-dimethyl-anilino)acetyl]amino]phenyl]benzamide Formula: C28H33N3O4S MolecularWeight: 507.64432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C)C

InChI

InChI=1S/C28H33N3O4S/c1-19-10-15-25(20(2)16-19)31(36(6,34)35)18-26(32)29-23-8-7-9-24(17-23)30-27(33)21-11-13-22(14-12-21)28(3,4)5/h7-17H,18H2,1-6H3,(H,29,32)(H,30,33)