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

Systemtic Name: 3-(4-methoxyphenyl)-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-(4-methoxyphenyl)-4-methyl-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-4-methyl-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-5-(4-methoxyphenyl)-4-methyl-1,2,4-triazole Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC=C)C2=CC=C(C=C2)OC

Isomeric SMILES

CN1C(=NN=C1SCC=C)C2=CC=C(C=C2)OC

InChI

InChI=1S/C13H15N3OS/c1-4-9-18-13-15-14-12(16(13)2)10-5-7-11(17-3)8-6-10/h4-8H,1,9H2,2-3H3