4-cyano-N-[3-(3-phenylmethoxypropoxy)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[3-(3-phenylmethoxypropoxy)quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(3-benzyloxypropoxy)quinoxalin-2-yl]-4-cyano-benzenesulfonamide CAS Name: 4-cyano-N-[3-(3-phenylmethoxypropoxy)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[3-(3-phenylmethoxypropoxy)quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-(3-benzoxypropoxy)quinoxalin-2-yl]-4-cyano-benzenesulfonamide Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCOC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)COCCCOC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H22N4O4S/c26-17-19-11-13-21(14-12-19)34(30,31)29-24-25(28-23-10-5-4-9-22(23)27-24)33-16-6-15-32-18-20-7-2-1-3-8-20/h1-5,7-14H,6,15-16,18H2,(H,27,29)