N-[6-[4-(5-bromanylpyrimidin-2-yl)oxybut-1-ynoxy]-5-(4-methylphenyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide

Systemtic Name: N-[6-[4-(5-bromanylpyrimidin-2-yl)oxybut-1-ynoxy]-5-(4-methylphenyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[6-[4-(5-bromopyrimidin-2-yl)oxybut-1-ynoxy]-5-(p-tolyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[6-[4-[(5-bromo-2-pyrimidinyl)oxy]but-1-ynoxy]-5-(4-methylphenyl)-4-pyrimidinyl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[6-[4-(5-bromopyrimidin-2-yl)oxybut-1-ynoxy]-5-(4-methylphenyl)pyrimidin-4-yl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[6-[4-(5-bromopyrimidin-2-yl)oxybut-1-ynoxy]-5-(p-tolyl)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Formula: C29H28BrN5O4S MolecularWeight: 622.53272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=CN=C2OC#CCCOC3=NC=C(C=N3)Br)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=CN=C2OC#CCCOC3=NC=C(C=N3)Br)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C29H28BrN5O4S/c1-20-7-9-21(10-8-20)25-26(35-40(36,37)24-13-11-22(12-14-24)29(2,3)4)33-19-34-27(25)38-15-5-6-16-39-28-31-17-23(30)18-32-28/h7-14,17-19H,6,16H2,1-4H3,(H,33,34,35)