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

Systemtic Name: 4-tert-butyl-N-[3-[2-[methylsulfonyl-(2-propan-2-ylphenyl)amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(2-isopropyl-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(N-methylsulfonyl-2-propan-2-ylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(N-methylsulfonyl-2-propan-2-ylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(2-isopropyl-N-mesyl-anilino)acetyl]amino]phenyl]benzamide Formula: C29H35N3O4S MolecularWeight: 521.6709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=CC=C1N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C29H35N3O4S/c1-20(2)25-12-7-8-13-26(25)32(37(6,35)36)19-27(33)30-23-10-9-11-24(18-23)31-28(34)21-14-16-22(17-15-21)29(3,4)5/h7-18,20H,19H2,1-6H3,(H,30,33)(H,31,34)