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

Systemtic Name: 4-methyl-3-(4-methylphenyl)-5-(2-methylpropylsulfanyl)-1,2,4-triazole Openeye Name: 3-isobutylsulfanyl-4-methyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 4-methyl-3-(4-methylphenyl)-5-(2-methylpropylthio)-1,2,4-triazole IUPAC Name: 4-methyl-3-(4-methylphenyl)-5-(2-methylpropylsulfanyl)-1,2,4-triazole Traditional Name: 3-(isobutylthio)-4-methyl-5-(p-tolyl)-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(C)C

InChI

InChI=1S/C14H19N3S/c1-10(2)9-18-14-16-15-13(17(14)4)12-7-5-11(3)6-8-12/h5-8,10H,9H2,1-4H3