4-tert-butyl-N-[6-(5,5-dicyanopent-4-enoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[6-(5,5-dicyanopent-4-enoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-(5,5-dicyanopent-4-enoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-(5,5-dicyanopent-4-enoxy)-5-(3-methoxyphenoxy)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-(5,5-dicyanopent-4-enoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-(5,5-dicyanopent-4-enoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Formula: C28H29N5O5S MolecularWeight: 547.62536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCCC=C(C#N)C#N)OC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCCC=C(C#N)C#N)OC3=CC(=CC=C3)OC

InChI

InChI=1S/C28H29N5O5S/c1-28(2,3)21-11-13-24(14-12-21)39(34,35)33-26-25(38-23-10-7-9-22(16-23)36-4)27(32-19-31-26)37-15-6-5-8-20(17-29)18-30/h7-14,16,19H,5-6,15H2,1-4H3,(H,31,32,33)