4-ethyl-3-[(4-methylphenoxy)methyl]-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(4-methylphenoxy)methyl]-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazole CAS Name: 4-ethyl-3-[(4-methylphenoxy)methyl]-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazole Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2)COC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)COC3=CC=C(C=C3)C

InChI

InChI=1S/C19H21N3OS/c1-3-22-18(13-23-17-11-9-15(2)10-12-17)20-21-19(22)24-14-16-7-5-4-6-8-16/h4-12H,3,13-14H2,1-2H3