2-[(1,3-benzodioxol-5-ylmethylamino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(1,3-benzodioxol-5-ylmethylamino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(1,3-benzodioxol-5-ylmethylamino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(1,3-benzodioxol-5-ylmethylamino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(1,3-benzodioxol-5-ylmethylamino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(piperonylamino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C15H13N3O3S/c19-15-14-10(3-4-22-14)17-13(18-15)7-16-6-9-1-2-11-12(5-9)21-8-20-11/h1-5,16H,6-8H2,(H,17,18,19)