3-[2-oxidanylidene-2-(2-oxidanylideneimidazolidin-1-yl)ethyl]-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-(2-oxidanylideneimidazolidin-1-yl)ethyl]-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-2-(piperidin-1-ium-1-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-(2-oxo-1-imidazolidinyl)ethyl]-2-(1-piperidin-1-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-(2-ketoimidazolidin-1-yl)ethyl]-2-(piperidin-1-ium-1-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H24N5O3S2+ MolecularWeight: 458.57696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC(=O)N5CCNC5=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC(=O)N5CCNC5=O

InChI

InChI=1S/C21H23N5O3S2/c27-17(25-9-6-22-21(25)29)12-26-16(11-24-7-2-1-3-8-24)23-19-18(20(26)28)14(13-31-19)15-5-4-10-30-15/h4-5,10,13H,1-3,6-9,11-12H2,(H,22,29)/p+1