2-(phenylsulfonyl)-2-[3-(phenylsulfonyl)quinoxalin-2-yl]ethanenitrile

Systemtic Name: 2-(phenylsulfonyl)-2-[3-(phenylsulfonyl)quinoxalin-2-yl]ethanenitrile Openeye Name: 2-(benzenesulfonyl)-2-[3-(benzenesulfonyl)quinoxalin-2-yl]acetonitrile CAS Name: 2-(benzenesulfonyl)-2-[3-(benzenesulfonyl)-2-quinoxalinyl]acetonitrile IUPAC Name: 2-(benzenesulfonyl)-2-[3-(benzenesulfonyl)quinoxalin-2-yl]acetonitrile Traditional Name: 2-besyl-2-(3-besylquinoxalin-2-yl)acetonitrile Formula: C22H15N3O4S2 MolecularWeight: 449.5022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H15N3O4S2/c23-15-20(30(26,27)16-9-3-1-4-10-16)21-22(25-19-14-8-7-13-18(19)24-21)31(28,29)17-11-5-2-6-12-17/h1-14,20H