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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-methyl-5-[(2-propan-2-ylphenoxy)methyl]-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-[(2-isopropylphenoxy)methyl]-4-methyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-4-methyl-5-[(2-propan-2-ylphenoxy)methyl]-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-methyl-5-[(2-propan-2-ylphenoxy)methyl]-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-[(2-isopropylphenoxy)methyl]-4-methyl-1,2,4-triazole Formula: C20H22ClN3OS MolecularWeight: 387.92618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC2=NN=C(N2C)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC2=NN=C(N2C)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN3OS/c1-14(2)17-6-4-5-7-18(17)25-12-19-22-23-20(24(19)3)26-13-15-8-10-16(21)11-9-15/h4-11,14H,12-13H2,1-3H3