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

Systemtic Name: 3-(2-chlorophenyl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-chlorophenyl)-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2-chlorophenyl)-4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(2-chlorophenyl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-chlorophenyl)-4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C17H16ClN3S MolecularWeight: 329.84704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H16ClN3S/c1-12-7-9-13(10-8-12)11-22-17-20-19-16(21(17)2)14-5-3-4-6-15(14)18/h3-10H,11H2,1-2H3