4-bromanyl-N-[3-(3-pyridin-3-ylpropoxy)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-(3-pyridin-3-ylpropoxy)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-[3-(3-pyridyl)propoxy]quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[3-(3-pyridinyl)propoxy]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(3-pyridin-3-ylpropoxy)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-[3-(3-pyridyl)propoxy]quinoxalin-2-yl]benzenesulfonamide Formula: C22H19BrN4O3S MolecularWeight: 499.38026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)OCCCC3=CN=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)OCCCC3=CN=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN4O3S/c23-17-9-11-18(12-10-17)31(28,29)27-21-22(26-20-8-2-1-7-19(20)25-21)30-14-4-6-16-5-3-13-24-15-16/h1-3,5,7-13,15H,4,6,14H2,(H,25,27)