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

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pentyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pentyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pentyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pentyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-amyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NNC(=S)N1C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCCC1=NNC(=S)N1C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H19N3O2S/c1-2-3-4-5-14-16-17-15(21)18(14)11-6-7-12-13(10-11)20-9-8-19-12/h6-7,10H,2-5,8-9H2,1H3,(H,17,21)