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

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dihydro-1H-inden-5-yloxymethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(indan-5-yloxymethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dihydro-1H-inden-5-yloxymethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dihydro-1H-inden-5-yloxymethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(indan-5-yloxymethyl)-1H-1,2,4-triazole-5-thione Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)OCC3=NNC(=S)N3C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)OCC3=NNC(=S)N3C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C20H19N3O3S/c27-20-22-21-19(12-26-16-6-4-13-2-1-3-14(13)10-16)23(20)15-5-7-17-18(11-15)25-9-8-24-17/h4-7,10-11H,1-3,8-9,12H2,(H,22,27)