3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-1,2,4-triazole CAS Name: 3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-1,2,4-triazole Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC=C)C2COC3=CC=CC=C3O2

Isomeric SMILES

CN1C(=NN=C1SCC=C)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C14H15N3O2S/c1-3-8-20-14-16-15-13(17(14)2)12-9-18-10-6-4-5-7-11(10)19-12/h3-7,12H,1,8-9H2,2H3/t12-/m1/s1