3-(4-tert-butylphenyl)-4-ethyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-4-ethyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-4-ethyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-4-ethyl-5-[2-(4-methoxyphenoxy)ethylthio]-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-4-ethyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-4-ethyl-5-[2-(4-methoxyphenoxy)ethylthio]-1,2,4-triazole Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O2S/c1-6-26-21(17-7-9-18(10-8-17)23(2,3)4)24-25-22(26)29-16-15-28-20-13-11-19(27-5)12-14-20/h7-14H,6,15-16H2,1-5H3