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

Systemtic Name: 4-(4-chlorophenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-(o-tolylmethylsulfanyl)-5-(p-tolyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-[(2-methylbenzyl)thio]-5-(p-tolyl)-1,2,4-triazole Formula: C23H20ClN3S MolecularWeight: 405.943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=CC=C4C

InChI

InChI=1S/C23H20ClN3S/c1-16-7-9-18(10-8-16)22-25-26-23(27(22)21-13-11-20(24)12-14-21)28-15-19-6-4-3-5-17(19)2/h3-14H,15H2,1-2H3