3-methyl-5-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC1=NOC(=C1)CSC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C13H12N4OS/c1-10-7-12(18-16-10)8-19-13-15-14-9-17(13)11-5-3-2-4-6-11/h2-7,9H,8H2,1H3