4-tert-butyl-N-[3-[2-[(2-methylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[(2-methylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-[2-methyl-N-(p-tolylsulfonyl)anilino]acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(2-methyl-N-tosyl-anilino)acetyl]amino]phenyl]benzamide Formula: C33H35N3O4S MolecularWeight: 569.7137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4C

InChI

InChI=1S/C33H35N3O4S/c1-23-13-19-29(20-14-23)41(39,40)36(30-12-7-6-9-24(30)2)22-31(37)34-27-10-8-11-28(21-27)35-32(38)25-15-17-26(18-16-25)33(3,4)5/h6-21H,22H2,1-5H3,(H,34,37)(H,35,38)