N-(4-methoxyphenyl)-5-methylsulfanyl-[1,2,4]triazolo[4,3-c]pyrimidin-3-amine

Systemtic Name: N-(4-methoxyphenyl)-5-methylsulfanyl-[1,2,4]triazolo[4,3-c]pyrimidin-3-amine Openeye Name: N-(4-methoxyphenyl)-5-methylsulfanyl-[1,2,4]triazolo[4,3-c]pyrimidin-3-amine CAS Name: N-(4-methoxyphenyl)-5-(methylthio)-[1,2,4]triazolo[4,3-c]pyrimidin-3-amine IUPAC Name: N-(4-methoxyphenyl)-5-methylsulfanyl-[1,2,4]triazolo[4,3-c]pyrimidin-3-amine Traditional Name: (4-methoxyphenyl)-[5-(methylthio)-[1,2,4]triazolo[4,3-c]pyrimidin-3-yl]amine Formula: C13H13N5OS MolecularWeight: 287.34022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C3N2C(=NC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C3N2C(=NC=C3)SC

InChI

InChI=1S/C13H13N5OS/c1-19-10-5-3-9(4-6-10)15-12-17-16-11-7-8-14-13(20-2)18(11)12/h3-8H,1-2H3,(H,15,17)