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

Systemtic Name: 5-(4-chlorophenyl)-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(4-chlorophenyl)-3-(p-tolylmethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(4-chlorophenyl)-3-[(4-methylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-chlorophenyl)-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(4-chlorophenyl)-3-[(4-methylbenzyl)thio]-1H-1,2,4-triazole Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3S/c1-11-2-4-12(5-3-11)10-21-16-18-15(19-20-16)13-6-8-14(17)9-7-13/h2-9H,10H2,1H3,(H,18,19,20)