5-(4-methoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(4-methoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-(4-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 5-(4-methoxyphenyl)-3-(prop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-methoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(allylthio)-5-(4-methoxyphenyl)-1H-1,2,4-triazole Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3OS/c1-3-8-17-12-13-11(14-15-12)9-4-6-10(16-2)7-5-9/h3-7H,1,8H2,2H3,(H,13,14,15)