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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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