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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-piperonyl-thieno[2,3-d]pyrimidin-4-one Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C16H14N2O3S/c1-9-10(2)22-15-14(9)16(19)18(7-17-15)6-11-3-4-12-13(5-11)21-8-20-12/h3-5,7H,6,8H2,1-2H3