2-[(4-tert-butylphenyl)carbonylamino]-N-(1H-indol-6-yl)-4-[methylperoxysulfanyl(methylsulfonyl)amino]benzamide

Systemtic Name: 2-[(4-tert-butylphenyl)carbonylamino]-N-(1H-indol-6-yl)-4-[methylperoxysulfanyl(methylsulfonyl)amino]benzamide Openeye Name: 2-[(4-tert-butylbenzoyl)amino]-N-(1H-indol-6-yl)-4-[methylperoxysulfanyl(methylsulfonyl)amino]benzamide CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]-N-(1H-indol-6-yl)-4-[(methyldioxythio)-methylsulfonylamino]benzamide IUPAC Name: 2-[(4-tert-butylbenzoyl)amino]-N-(1H-indol-6-yl)-4-[methylperoxysulfanyl(methylsulfonyl)amino]benzamide Traditional Name: 2-[(4-tert-butylbenzoyl)amino]-N-(1H-indol-6-yl)-4-[mesyl-(methylperoxythio)amino]benzamide Formula: C28H30N4O6S2 MolecularWeight: 582.691

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)N(SOOC)S(=O)(=O)C)C(=O)NC3=CC4=C(C=C3)C=CN4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)N(SOOC)S(=O)(=O)C)C(=O)NC3=CC4=C(C=C3)C=CN4

InChI

InChI=1S/C28H30N4O6S2/c1-28(2,3)20-9-6-19(7-10-20)26(33)31-25-17-22(32(39-38-37-4)40(5,35)36)12-13-23(25)27(34)30-21-11-8-18-14-15-29-24(18)16-21/h6-17,29H,1-5H3,(H,30,34)(H,31,33)