4-tert-butyl-N-[5-(4-methylphenyl)-2-methylsulfonyl-6-(2-phenylmethoxyethoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[5-(4-methylphenyl)-2-methylsulfonyl-6-(2-phenylmethoxyethoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: N-[6-(2-benzyloxyethoxy)-2-methylsulfonyl-5-(p-tolyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide CAS Name: 4-tert-butyl-N-[5-(4-methylphenyl)-2-methylsulfonyl-6-(2-phenylmethoxyethoxy)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[5-(4-methylphenyl)-2-methylsulfonyl-6-(2-phenylmethoxyethoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: N-[6-(2-benzoxyethoxy)-2-mesyl-5-(p-tolyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Formula: C31H35N3O6S2 MolecularWeight: 609.7561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N=C2OCCOCC3=CC=CC=C3)S(=O)(=O)C)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N=C2OCCOCC3=CC=CC=C3)S(=O)(=O)C)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C31H35N3O6S2/c1-22-11-13-24(14-12-22)27-28(34-42(37,38)26-17-15-25(16-18-26)31(2,3)4)32-30(41(5,35)36)33-29(27)40-20-19-39-21-23-9-7-6-8-10-23/h6-18H,19-21H2,1-5H3,(H,32,33,34)