2-(4-fluorophenyl)sulfonyl-2-(3-phenylsulfanylquinoxalin-2-yl)ethanenitrile

Systemtic Name: 2-(4-fluorophenyl)sulfonyl-2-(3-phenylsulfanylquinoxalin-2-yl)ethanenitrile Openeye Name: 2-(4-fluorophenyl)sulfonyl-2-(3-phenylsulfanylquinoxalin-2-yl)acetonitrile CAS Name: 2-(4-fluorophenyl)sulfonyl-2-[3-(phenylthio)-2-quinoxalinyl]acetonitrile IUPAC Name: 2-(4-fluorophenyl)sulfonyl-2-(3-phenylsulfanylquinoxalin-2-yl)acetonitrile Traditional Name: 2-(4-fluorophenyl)sulfonyl-2-[3-(phenylthio)quinoxalin-2-yl]acetonitrile Formula: C22H14FN3O2S2 MolecularWeight: 435.493863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H14FN3O2S2/c23-15-10-12-17(13-11-15)30(27,28)20(14-24)21-22(29-16-6-2-1-3-7-16)26-19-9-5-4-8-18(19)25-21/h1-13,20H