2-[[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-piperonyloylpiperazino)methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H20N4O4S2 MolecularWeight: 480.5593

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCN1CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C23H20N4O4S2/c28-21-20-15(18-2-1-9-32-18)12-33-22(20)25-19(24-21)11-26-5-7-27(8-6-26)23(29)14-3-4-16-17(10-14)31-13-30-16/h1-4,9-10,12H,5-8,11,13H2,(H,24,25,28)