N-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-piperonylamide Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=NNC1=S)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H12N4O3S/c1-16-10(14-15-12(16)20)5-13-11(17)7-2-3-8-9(4-7)19-6-18-8/h2-4H,5-6H2,1H3,(H,13,17)(H,15,20)