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

Systemtic Name: 4-methyl-3-[(3-methylphenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Openeye Name: 4-methyl-3-(m-tolylmethylsulfanyl)-5-(1-naphthylmethyl)-1,2,4-triazole CAS Name: 4-methyl-3-[(3-methylphenyl)methylthio]-5-(1-naphthalenylmethyl)-1,2,4-triazole IUPAC Name: 4-methyl-3-[(3-methylphenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Traditional Name: 4-methyl-3-[(3-methylbenzyl)thio]-5-(1-naphthylmethyl)-1,2,4-triazole Formula: C22H21N3S MolecularWeight: 359.48724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2C)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2C)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H21N3S/c1-16-7-5-8-17(13-16)15-26-22-24-23-21(25(22)2)14-19-11-6-10-18-9-3-4-12-20(18)19/h3-13H,14-15H2,1-2H3