5-[(4-chloranyl-3-methyl-phenoxy)methyl]-3-(2-chloranylprop-2-enylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-[(4-chloranyl-3-methyl-phenoxy)methyl]-3-(2-chloranylprop-2-enylsulfanyl)-1H-1,2,4-triazole Openeye Name: 3-(2-chloroallylsulfanyl)-5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazole CAS Name: 5-[(4-chloro-3-methylphenoxy)methyl]-3-(2-chloroprop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-[(4-chloro-3-methylphenoxy)methyl]-3-(2-chloroprop-2-enylsulfanyl)-1H-1,2,4-triazole Traditional Name: 3-(2-chloroallylthio)-5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazole Formula: C13H13Cl2N3OS MolecularWeight: 330.23282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC(=NN2)SCC(=C)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC(=NN2)SCC(=C)Cl)Cl

InChI

InChI=1S/C13H13Cl2N3OS/c1-8-5-10(3-4-11(8)15)19-6-12-16-13(18-17-12)20-7-9(2)14/h3-5H,2,6-7H2,1H3,(H,16,17,18)