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

Systemtic Name: 3,4-bis(4-chlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-bis(4-chlorophenyl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3,4-bis(4-chlorophenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3,4-bis(4-chlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-bis(4-chlorophenyl)-5-[(3-methylbenzyl)thio]-1,2,4-triazole Formula: C22H17Cl2N3S MolecularWeight: 426.36148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17Cl2N3S/c1-15-3-2-4-16(13-15)14-28-22-26-25-21(17-5-7-18(23)8-6-17)27(22)20-11-9-19(24)10-12-20/h2-13H,14H2,1H3