3-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 6-phenyl-3-piperonyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H14N2O3S MolecularWeight: 362.40176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C=NC4=C(C3=O)C=C(S4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C=NC4=C(C3=O)C=C(S4)C5=CC=CC=C5

InChI

InChI=1S/C20H14N2O3S/c23-20-15-9-18(14-4-2-1-3-5-14)26-19(15)21-11-22(20)10-13-6-7-16-17(8-13)25-12-24-16/h1-9,11H,10,12H2