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

Systemtic Name: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,2,4-triazole Openeye Name: 3-[(2-isopropyl-5-methyl-phenoxy)methyl]-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-[(4-methylphenyl)methylthio]-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,2,4-triazole IUPAC Name: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,2,4-triazole Traditional Name: 3-[(2-isopropyl-5-methyl-phenoxy)methyl]-4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C)COC3=C(C=CC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C)COC3=C(C=CC(=C3)C)C(C)C

InChI

InChI=1S/C22H27N3OS/c1-15(2)19-11-8-17(4)12-20(19)26-13-21-23-24-22(25(21)5)27-14-18-9-6-16(3)7-10-18/h6-12,15H,13-14H2,1-5H3