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

Systemtic Name: 3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-ethylphenoxy)methyl]-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-ethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-ethylphenoxy)methyl]-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3OS/c1-4-14-25-21(15-26-20-12-10-18(5-2)11-13-20)23-24-22(25)27-16-19-8-6-17(3)7-9-19/h4,6-13H,1,5,14-16H2,2-3H3