6-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 6-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 6-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 6-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 6-piperonyl-4-[(E)-piperonylideneamino]-3-thioxo-2H-1,2,4-triazin-5-one Formula: C19H14N4O5S MolecularWeight: 410.40326

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC3=NNC(=S)N(C3=O)N=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC3=NNC(=S)N(C3=O)/N=C/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H14N4O5S/c24-18-13(5-11-1-3-14-16(6-11)27-9-25-14)21-22-19(29)23(18)20-8-12-2-4-15-17(7-12)28-10-26-15/h1-4,6-8H,5,9-10H2,(H,22,29)/b20-8+