4-(3-chloranyl-4-methyl-phenyl)-3-[(2-methylphenyl)methylsulfanylmethyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-chloranyl-4-methyl-phenyl)-3-[(2-methylphenyl)methylsulfanylmethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-chloro-4-methyl-phenyl)-3-(o-tolylmethylsulfanylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-chloro-4-methylphenyl)-3-[[(2-methylphenyl)methylthio]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-chloro-4-methylphenyl)-3-[(2-methylphenyl)methylsulfanylmethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-chloro-4-methyl-phenyl)-3-[[(2-methylbenzyl)thio]methyl]-1H-1,2,4-triazole-5-thione Formula: C18H18ClN3S2 MolecularWeight: 375.93862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NNC2=S)CSCC3=CC=CC=C3C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NNC2=S)CSCC3=CC=CC=C3C)Cl

InChI

InChI=1S/C18H18ClN3S2/c1-12-5-3-4-6-14(12)10-24-11-17-20-21-18(23)22(17)15-8-7-13(2)16(19)9-15/h3-9H,10-11H2,1-2H3,(H,21,23)