4-ethyl-3-[(3-methylphenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(3-methylphenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazole Openeye Name: 4-ethyl-3-isopropyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(3-methylphenyl)methylthio]-5-propan-2-yl-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(3-methylphenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazole Traditional Name: 4-ethyl-3-isopropyl-5-[(3-methylbenzyl)thio]-1,2,4-triazole Formula: C15H21N3S MolecularWeight: 275.41234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC(=C2)C)C(C)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC(=C2)C)C(C)C

InChI

InChI=1S/C15H21N3S/c1-5-18-14(11(2)3)16-17-15(18)19-10-13-8-6-7-12(4)9-13/h6-9,11H,5,10H2,1-4H3