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

Systemtic Name: 5-[(4-chloranyl-3-methyl-phenoxy)methyl]-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-[(4-chloro-3-methylphenoxy)methyl]-3-(3-methylbut-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-[(4-chloro-3-methylphenoxy)methyl]-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-3-(3-methylbut-2-enylthio)-1H-1,2,4-triazole Formula: C15H18ClN3OS MolecularWeight: 323.84092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN3OS/c1-10(2)6-7-21-15-17-14(18-19-15)9-20-12-4-5-13(16)11(3)8-12/h4-6,8H,7,9H2,1-3H3,(H,17,18,19)