5-(5-chloranyl-2-methoxy-phenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-(prop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(allylthio)-5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazole Formula: C12H12ClN3OS MolecularWeight: 281.76118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCC=C

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCC=C

InChI

InChI=1S/C12H12ClN3OS/c1-3-6-18-12-14-11(15-16-12)9-7-8(13)4-5-10(9)17-2/h3-5,7H,1,6H2,2H3,(H,14,15,16)