3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-1H-1,2,4-triazole-5-thione Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCN1C(=NNC1=S)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C12H13N3O2S/c1-2-15-11(13-14-12(15)18)8-3-4-9-10(7-8)17-6-5-16-9/h3-4,7H,2,5-6H2,1H3,(H,14,18)