3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,2,4-triazole

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(2-isopropyl-5-methyl-phenoxy)methyl]-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-4-ethyl-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-4-ethyl-5-[(2-isopropyl-5-methyl-phenoxy)methyl]-1,2,4-triazole Formula: C22H26ClN3OS MolecularWeight: 415.97934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3OS/c1-5-26-21(13-27-20-12-16(4)6-11-19(20)15(2)3)24-25-22(26)28-14-17-7-9-18(23)10-8-17/h6-12,15H,5,13-14H2,1-4H3