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

Systemtic Name: 5-(4-methylphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 3-(o-tolylmethylsulfanyl)-5-(p-tolyl)-1H-1,2,4-triazole CAS Name: 5-(4-methylphenyl)-3-[(2-methylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-methylphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 3-[(2-methylbenzyl)thio]-5-(p-tolyl)-1H-1,2,4-triazole Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC=C3C

InChI

InChI=1S/C17H17N3S/c1-12-7-9-14(10-8-12)16-18-17(20-19-16)21-11-15-6-4-3-5-13(15)2/h3-10H,11H2,1-2H3,(H,18,19,20)