5-(1,3-benzodioxol-5-yl)-2,4-dimethyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-2,4-dimethyl-1,2,4-triazole-3-thione Openeye Name: 5-(1,3-benzodioxol-5-yl)-2,4-dimethyl-1,2,4-triazole-3-thione CAS Name: 5-(1,3-benzodioxol-5-yl)-2,4-dimethyl-1,2,4-triazole-3-thione IUPAC Name: 5-(1,3-benzodioxol-5-yl)-2,4-dimethyl-1,2,4-triazole-3-thione Traditional Name: 5-(1,3-benzodioxol-5-yl)-2,4-dimethyl-1,2,4-triazole-3-thione Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=NN(C1=S)C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C11H11N3O2S/c1-13-10(12-14(2)11(13)17)7-3-4-8-9(5-7)16-6-15-8/h3-5H,6H2,1-2H3