4-octyl-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-octyl-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-octyl-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-octyl-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-octyl-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-octyl-N-(2-pyrimidyl)benzenesulfonamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2

InChI

InChI=1S/C18H25N3O2S/c1-2-3-4-5-6-7-9-16-10-12-17(13-11-16)24(22,23)21-18-19-14-8-15-20-18/h8,10-15H,2-7,9H2,1H3,(H,19,20,21)