2-(pyridin-2-ylmethylsulfanyl)-3-quinoxalin-2-yl-quinoxaline

Systemtic Name: 2-(pyridin-2-ylmethylsulfanyl)-3-quinoxalin-2-yl-quinoxaline Openeye Name: 2-(2-pyridylmethylsulfanyl)-3-quinoxalin-2-yl-quinoxaline CAS Name: 2-(2-pyridinylmethylthio)-3-(2-quinoxalinyl)quinoxaline IUPAC Name: 2-(pyridin-2-ylmethylsulfanyl)-3-quinoxalin-2-ylquinoxaline Traditional Name: 2-(2-pyridylmethylthio)-3-quinoxalin-2-yl-quinoxaline Formula: C22H15N5S MolecularWeight: 381.453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)C3=NC4=CC=CC=C4N=C3SCC5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)C3=NC4=CC=CC=C4N=C3SCC5=CC=CC=N5

InChI

InChI=1S/C22H15N5S/c1-2-9-17-16(8-1)24-13-20(25-17)21-22(28-14-15-7-5-6-12-23-15)27-19-11-4-3-10-18(19)26-21/h1-13H,14H2