4-butyl-N-[6-(2-hydroxyethyloxy)-5-(4-methylphenyl)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[6-(2-hydroxyethyloxy)-5-(4-methylphenyl)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-butyl-N-[6-(2-hydroxyethoxy)-5-(p-tolyl)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-butyl-N-[6-(2-hydroxyethoxy)-5-(4-methylphenyl)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[6-(2-hydroxyethoxy)-5-(4-methylphenyl)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-butyl-N-[6-(2-hydroxyethoxy)-5-(p-tolyl)pyrimidin-4-yl]benzenesulfonamide Formula: C23H27N3O4S MolecularWeight: 441.54318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCO)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCO)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H27N3O4S/c1-3-4-5-18-8-12-20(13-9-18)31(28,29)26-22-21(19-10-6-17(2)7-11-19)23(25-16-24-22)30-15-14-27/h6-13,16,27H,3-5,14-15H2,1-2H3,(H,24,25,26)