N-[6-[2-(4-bromanylphenoxy)ethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]-2-phenyl-ethanesulfonamide

Systemtic Name: N-[6-[2-(4-bromanylphenoxy)ethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]-2-phenyl-ethanesulfonamide Openeye Name: N-[6-[2-(4-bromophenoxy)ethoxy]-5-(p-tolyl)pyrimidin-4-yl]-2-phenyl-ethanesulfonamide CAS Name: N-[6-[2-(4-bromophenoxy)ethoxy]-5-(4-methylphenyl)-4-pyrimidinyl]-2-phenylethanesulfonamide IUPAC Name: N-[6-[2-(4-bromophenoxy)ethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]-2-phenylethanesulfonamide Traditional Name: N-[6-[2-(4-bromophenoxy)ethoxy]-5-(p-tolyl)pyrimidin-4-yl]-2-phenyl-ethanesulfonamide Formula: C27H26BrN3O4S MolecularWeight: 568.48204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=CN=C2OCCOC3=CC=C(C=C3)Br)NS(=O)(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=CN=C2OCCOC3=CC=C(C=C3)Br)NS(=O)(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C27H26BrN3O4S/c1-20-7-9-22(10-8-20)25-26(31-36(32,33)18-15-21-5-3-2-4-6-21)29-19-30-27(25)35-17-16-34-24-13-11-23(28)12-14-24/h2-14,19H,15-18H2,1H3,(H,29,30,31)