1-(oxan-2-ylmethylsulfanyl)-3H-[1,2,4]triazolo[4,3-a]benzimidazole

Systemtic Name: 1-(oxan-2-ylmethylsulfanyl)-3H-[1,2,4]triazolo[4,3-a]benzimidazole Openeye Name: 1-(tetrahydropyran-2-ylmethylsulfanyl)-3H-[1,2,4]triazolo[4,3-a]benzimidazole CAS Name: 1-(2-oxanylmethylthio)-3H-[1,2,4]triazolo[4,3-a]benzimidazole IUPAC Name: 1-(oxan-2-ylmethylsulfanyl)-3H-[1,2,4]triazolo[4,3-a]benzimidazole Traditional Name: 1-(tetrahydropyran-2-ylmethylthio)-3H-[1,2,4]triazolo[4,3-a]benzimidazole Formula: C14H16N4OS MolecularWeight: 288.36804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NNC3=NC4=CC=CC=C4N32

Isomeric SMILES

C1CCOC(C1)CSC2=NNC3=NC4=CC=CC=C4N32

InChI

InChI=1S/C14H16N4OS/c1-2-7-12-11(6-1)15-13-16-17-14(18(12)13)20-9-10-5-3-4-8-19-10/h1-2,6-7,10H,3-5,8-9H2,(H,15,16)