5-(methylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-(methylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-(methylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-[(methylthio)methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-(methylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-[(methylthio)methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C7H8N4OS MolecularWeight: 196.22962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC(=O)N2C(=N1)N=CN2

Isomeric SMILES

CSCC1=CC(=O)N2C(=N1)N=CN2

InChI

InChI=1S/C7H8N4OS/c1-13-3-5-2-6(12)11-7(10-5)8-4-9-11/h2,4H,3H2,1H3,(H,8,9,10)