5-methyl-3-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-1,2-oxazole

Systemtic Name: 5-methyl-3-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-1,2-oxazole Openeye Name: 5-methyl-3-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)isoxazole CAS Name: 5-methyl-3-[5-(methylthio)-4-phenyl-1,2,4-triazol-3-yl]isoxazole IUPAC Name: 5-methyl-3-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-1,2-oxazole Traditional Name: 5-methyl-3-[5-(methylthio)-4-phenyl-1,2,4-triazol-3-yl]isoxazole Formula: C13H12N4OS MolecularWeight: 272.32558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2=NN=C(N2C3=CC=CC=C3)SC

Isomeric SMILES

CC1=CC(=NO1)C2=NN=C(N2C3=CC=CC=C3)SC

InChI

InChI=1S/C13H12N4OS/c1-9-8-11(16-18-9)12-14-15-13(19-2)17(12)10-6-4-3-5-7-10/h3-8H,1-2H3