4-methyl-3-(3-methylphenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-methyl-3-(3-methylphenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-methyl-3-(m-tolyl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-(3-methylphenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-methyl-3-(3-methylphenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-methyl-3-[(3-methylbenzyl)thio]-5-(m-tolyl)-1,2,4-triazole Formula: C18H19N3S MolecularWeight: 309.42856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2C)C3=CC(=CC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2C)C3=CC(=CC=C3)C

InChI

InChI=1S/C18H19N3S/c1-13-6-4-8-15(10-13)12-22-18-20-19-17(21(18)3)16-9-5-7-14(2)11-16/h4-11H,12H2,1-3H3