4-tert-butyl-N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-ethyl-6-(2-methylsulfanylethoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-ethyl-6-(2-methylsulfanylethoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[5-(2-chloro-5-methoxy-phenoxy)-2-ethyl-6-(2-methylsulfanylethoxy)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[5-(2-chloro-5-methoxyphenoxy)-2-ethyl-6-[2-(methylthio)ethoxy]-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[5-(2-chloro-5-methoxyphenoxy)-2-ethyl-6-(2-methylsulfanylethoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[5-(2-chloro-5-methoxy-phenoxy)-2-ethyl-6-[2-(methylthio)ethoxy]pyrimidin-4-yl]benzenesulfonamide Formula: C26H32ClN3O5S2 MolecularWeight: 566.13238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)OCCSC)OC2=C(C=CC(=C2)OC)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)OCCSC)OC2=C(C=CC(=C2)OC)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H32ClN3O5S2/c1-7-22-28-24(30-37(31,32)19-11-8-17(9-12-19)26(2,3)4)23(25(29-22)34-14-15-36-6)35-21-16-18(33-5)10-13-20(21)27/h8-13,16H,7,14-15H2,1-6H3,(H,28,29,30)