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

Systemtic Name: 5-(4-ethylphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(4-ethylphenyl)-3-(o-tolylmethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(4-ethylphenyl)-3-[(2-methylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-ethylphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(4-ethylphenyl)-3-[(2-methylbenzyl)thio]-1H-1,2,4-triazole Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC=C3C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC=C3C

InChI

InChI=1S/C18H19N3S/c1-3-14-8-10-15(11-9-14)17-19-18(21-20-17)22-12-16-7-5-4-6-13(16)2/h4-11H,3,12H2,1-2H3,(H,19,20,21)