5-methyl-7-phenylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-7-phenylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 5-methyl-7-phenylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5-methyl-7-(phenylthio)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 5-methyl-7-phenylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 5-methyl-7-(phenylthio)-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C12H10N4S MolecularWeight: 242.2996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC=NN2C(=C1)SC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=NC=NN2C(=C1)SC3=CC=CC=C3

InChI

InChI=1S/C12H10N4S/c1-9-7-11(16-12(15-9)13-8-14-16)17-10-5-3-2-4-6-10/h2-8H,1H3