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

Systemtic Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[1-(4-ethylphenoxy)ethyl]-4-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)OC(C)C2=NN=C(N2C)SCC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2C)SCC3=CC=C(C=C3)C

InChI

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