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

Systemtic Name: 3-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(4-pyrazol-1-ylbenzyl)thio]-1,2,4-triazole Formula: C22H20ClN5OS MolecularWeight: 437.9451

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)N4C=CC=N4)COC5=CC=CC=C5Cl

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)N4C=CC=N4)COC5=CC=CC=C5Cl

InChI

InChI=1S/C22H20ClN5OS/c23-19-4-1-2-5-20(19)29-14-21-25-26-22(28(21)18-10-11-18)30-15-16-6-8-17(9-7-16)27-13-3-12-24-27/h1-9,12-13,18H,10-11,14-15H2