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

Systemtic Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-(2-methylpropylsulfanyl)-1,2,4-triazole Openeye Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-isobutylsulfanyl-1,2,4-triazole CAS Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-(2-methylpropylthio)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-(2-methylpropylsulfanyl)-1,2,4-triazole Traditional Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-(isobutylthio)-1,2,4-triazole Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC)SCC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC)SCC(C)C

InChI

InChI=1S/C17H25N3OS/c1-5-14-7-9-15(10-8-14)21-11-16-18-19-17(20(16)6-2)22-12-13(3)4/h7-10,13H,5-6,11-12H2,1-4H3