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

Systemtic Name: 3,4-diethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-diethyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3,4-diethyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3,4-diethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-diethyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC)SCC2=CC=C(C=C2)C

Isomeric SMILES

CCC1=NN=C(N1CC)SCC2=CC=C(C=C2)C

InChI

InChI=1S/C14H19N3S/c1-4-13-15-16-14(17(13)5-2)18-10-12-8-6-11(3)7-9-12/h6-9H,4-5,10H2,1-3H3