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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-methyl-1H-1,2,4-triazole Formula: C10H10ClN3S MolecularWeight: 239.7245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NC(=NN1)SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C10H10ClN3S/c1-7-12-10(14-13-7)15-6-8-2-4-9(11)5-3-8/h2-5H,6H2,1H3,(H,12,13,14)