4-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-(piperonylamino)-1H-1,2,4-triazole-5-thione Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NNC(=S)N1NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C11H12N4O2S/c1-7-13-14-11(18)15(7)12-5-8-2-3-9-10(4-8)17-6-16-9/h2-4,12H,5-6H2,1H3,(H,14,18)