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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCN3C=NNC3=S

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCN3C=NNC3=S

InChI

InChI=1S/C12H13N3O2S/c18-12-14-13-8-15(12)4-3-9-1-2-10-11(7-9)17-6-5-16-10/h1-2,7-8H,3-6H2,(H,14,18)