N-(1,3-benzodioxol-5-ylmethyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide Traditional Name: 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-N-piperonyl-acetamide Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5

InChI

InChI=1S/C22H17N3O4S/c26-20(23-10-14-6-7-17-18(8-14)29-13-28-17)11-27-21-16-9-19(15-4-2-1-3-5-15)30-22(16)25-12-24-21/h1-9,12H,10-11,13H2,(H,23,26)