4-ethyl-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole Openeye Name: 4-ethyl-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole CAS Name: 4-ethyl-3-(methylthio)-5-(phenoxymethyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole Traditional Name: 4-ethyl-3-(methylthio)-5-(phenoxymethyl)-1,2,4-triazole Formula: C12H15N3OS MolecularWeight: 249.332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC)COC2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SC)COC2=CC=CC=C2

InChI

InChI=1S/C12H15N3OS/c1-3-15-11(13-14-12(15)17-2)9-16-10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3