3-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(2-methoxy-5-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(2-methoxy-5-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(2-methoxy-5-methyl-benzyl)thio]-1,2,4-triazole Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2C3CC3)COC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2C3CC3)COC4=CC=CC=C4Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-14-7-10-18(26-2)15(11-14)13-28-21-24-23-20(25(21)16-8-9-16)12-27-19-6-4-3-5-17(19)22/h3-7,10-11,16H,8-9,12-13H2,1-2H3