3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole

Systemtic Name: 3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole Openeye Name: 3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-ethyl-5-(2-furyl)-1,2,4-triazole CAS Name: 3-[2-(2,5-dimethylphenoxy)ethylthio]-4-ethyl-5-(2-furanyl)-1,2,4-triazole IUPAC Name: 3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole Traditional Name: 3-[2-(2,5-dimethylphenoxy)ethylthio]-4-ethyl-5-(2-furyl)-1,2,4-triazole Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCOC2=C(C=CC(=C2)C)C)C3=CC=CO3

Isomeric SMILES

CCN1C(=NN=C1SCCOC2=C(C=CC(=C2)C)C)C3=CC=CO3

InChI

InChI=1S/C18H21N3O2S/c1-4-21-17(15-6-5-9-22-15)19-20-18(21)24-11-10-23-16-12-13(2)7-8-14(16)3/h5-9,12H,4,10-11H2,1-3H3