N-(1,3-benzodioxol-5-ylmethyl)-2-(7-oxidanylidenethieno[2,3-d]pyridazin-6-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-oxidanylidenethieno[2,3-d]pyridazin-6-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-oxothieno[2,3-d]pyridazin-6-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-oxo-6-thieno[2,3-d]pyridazinyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-oxothieno[2,3-d]pyridazin-6-yl)acetamide Traditional Name: 2-(7-ketothieno[2,3-d]pyridazin-6-yl)-N-piperonyl-acetamide Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C(=O)C4=C(C=CS4)C=N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C(=O)C4=C(C=CS4)C=N3

InChI

InChI=1S/C16H13N3O4S/c20-14(8-19-16(21)15-11(7-18-19)3-4-24-15)17-6-10-1-2-12-13(5-10)23-9-22-12/h1-5,7H,6,8-9H2,(H,17,20)