4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC)SCC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC)SCC3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N3OS/c1-4-17-10-12-19(13-11-17)25-14-20-22-23-21(24(20)5-2)26-15-18-8-6-16(3)7-9-18/h6-13H,4-5,14-15H2,1-3H3