5-(1,3-benzodioxol-5-ylmethylamino)-6-methyl-2H-1,2,4-triazine-3-thione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylamino)-6-methyl-2H-1,2,4-triazine-3-thione Openeye Name: 5-(1,3-benzodioxol-5-ylmethylamino)-6-methyl-2H-1,2,4-triazine-3-thione CAS Name: 5-(1,3-benzodioxol-5-ylmethylamino)-6-methyl-2H-1,2,4-triazine-3-thione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylamino)-6-methyl-2H-1,2,4-triazine-3-thione Traditional Name: 6-methyl-5-(piperonylamino)-2H-1,2,4-triazine-3-thione Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N=C1NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NNC(=S)N=C1NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H12N4O2S/c1-7-11(14-12(19)16-15-7)13-5-8-2-3-9-10(4-8)18-6-17-9/h2-4H,5-6H2,1H3,(H2,13,14,16,19)