6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-5-methyl-3-propyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-5-methyl-3-propyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-5-methyl-3-propyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-5-methyl-3-propyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-5-methyl-3-propylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-methyl-6-(4-piperonylpiperazine-1-carbonyl)-3-propyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C23H26N4O4S/c1-3-6-27-13-24-21-19(22(27)28)15(2)20(32-21)23(29)26-9-7-25(8-10-26)12-16-4-5-17-18(11-16)31-14-30-17/h4-5,11,13H,3,6-10,12,14H2,1-2H3