N-[3-(2,2-dimethylpropanoylamino)phenyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide Openeye Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide Traditional Name: 4-[methyl(tosyl)amino]-N-[3-(pivaloylamino)phenyl]benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C(C)(C)C

InChI

InChI=1S/C26H29N3O4S/c1-18-9-15-23(16-10-18)34(32,33)29(5)22-13-11-19(12-14-22)24(30)27-20-7-6-8-21(17-20)28-25(31)26(2,3)4/h6-17H,1-5H3,(H,27,30)(H,28,31)