N-[6-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]furan-2-carboxamide

Systemtic Name: N-[6-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]furan-2-carboxamide Openeye Name: N-[6-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]sulfanylpyridazin-3-yl]furan-2-carboxamide CAS Name: N-[6-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]thio]-3-pyridazinyl]-2-furancarboxamide IUPAC Name: N-[6-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]sulfanylpyridazin-3-yl]furan-2-carboxamide Traditional Name: N-[6-[[2-keto-2-(piperonylamino)ethyl]thio]pyridazin-3-yl]-2-furamide Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NN=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NN=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C19H16N4O5S/c24-17(20-9-12-3-4-13-15(8-12)28-11-27-13)10-29-18-6-5-16(22-23-18)21-19(25)14-2-1-7-26-14/h1-8H,9-11H2,(H,20,24)(H,21,22,25)