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

Systemtic Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-4-methyl-5-(4-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-4-methyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-[(3,4-dichlorophenyl)methylthio]-4-methyl-5-(4-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-4-methyl-5-(4-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(3,4-dichlorobenzyl)thio]-4-methyl-5-(p-tolyl)-1,2,4-triazole Formula: C17H15Cl2N3S MolecularWeight: 364.2921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H15Cl2N3S/c1-11-3-6-13(7-4-11)16-20-21-17(22(16)2)23-10-12-5-8-14(18)15(19)9-12/h3-9H,10H2,1-2H3