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

Systemtic Name: 4-tert-butyl-N-[6-chloranyl-5-(4-methylphenyl)-2-phenyl-pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-chloro-2-phenyl-5-(p-tolyl)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-chloro-5-(4-methylphenyl)-2-phenyl-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-chloro-5-(4-methylphenyl)-2-phenylpyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-chloro-2-phenyl-5-(p-tolyl)pyrimidin-4-yl]benzenesulfonamide Formula: C27H26ClN3O2S MolecularWeight: 492.03224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N=C2Cl)C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N=C2Cl)C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H26ClN3O2S/c1-18-10-12-19(13-11-18)23-24(28)29-25(20-8-6-5-7-9-20)30-26(23)31-34(32,33)22-16-14-21(15-17-22)27(2,3)4/h5-17H,1-4H3,(H,29,30,31)