2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-6-ethanoyl-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-6-ethanoyl-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-acetyl-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-acetyl-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-acetyl-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-acetyl-5-methyl-2-[[methyl(piperonyl)amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O4S/c1-10-16-18(24)20-15(21-19(16)27-17(10)11(2)23)8-22(3)7-12-4-5-13-14(6-12)26-9-25-13/h4-6H,7-9H2,1-3H3,(H,20,21,24)