4-methyl-3-(3-methylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-(3-methylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 4-methyl-3-(m-tolyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-(3-methylphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazole IUPAC Name: 4-methyl-3-(3-methylphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 4-methyl-3-(m-tolyl)-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C18H19N3OS MolecularWeight: 325.42796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2C)SCCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C)SCCOC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-14-7-6-8-15(13-14)17-19-20-18(21(17)2)23-12-11-22-16-9-4-3-5-10-16/h3-10,13H,11-12H2,1-2H3