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

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3C(=NNC3=S)CC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3C(=NNC3=S)CC4=CC=CC=C4

InChI

InChI=1S/C17H15N3O2S/c23-17-19-18-16(10-12-4-2-1-3-5-12)20(17)13-6-7-14-15(11-13)22-9-8-21-14/h1-7,11H,8-10H2,(H,19,23)