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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-4-ethyl-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-4-ethyl-5-(o-tolyl)-1,2,4-triazole Formula: C18H18ClN3S MolecularWeight: 343.87362

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC=CC=C3C

InChI

InChI=1S/C18H18ClN3S/c1-3-22-17(16-7-5-4-6-13(16)2)20-21-18(22)23-12-14-8-10-15(19)11-9-14/h4-11H,3,12H2,1-2H3