4-tert-butyl-N-[3-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)propanoylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(5-chloro-2-methyl-N-methylsulfonylanilino)-1-oxopropyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanoylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-(5-chloro-N-mesyl-2-methyl-anilino)propanoylamino]phenyl]benzamide Formula: C28H32ClN3O4S MolecularWeight: 542.08938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32ClN3O4S/c1-18-10-15-22(29)16-25(18)32(37(6,35)36)19(2)26(33)30-23-8-7-9-24(17-23)31-27(34)20-11-13-21(14-12-20)28(3,4)5/h7-17,19H,1-6H3,(H,30,33)(H,31,34)