N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-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)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

InChI

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