3-(2-oxidanylidene-2-pyrrolidin-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-pyrrolidin-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-pyrrolidin-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-(1-pyrrolidinyl)ethyl]-2-(1-piperidin-1-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2-oxo-2-pyrrolidin-1-ylethyl)-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-keto-2-pyrrolidino-ethyl)-2-(piperidin-1-ium-1-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H27N4O2S2+ MolecularWeight: 443.60538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC(=O)N5CCCC5

Isomeric SMILES

C1CC[NH+](CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC(=O)N5CCCC5

InChI

InChI=1S/C22H26N4O2S2/c27-19(25-10-4-5-11-25)14-26-18(13-24-8-2-1-3-9-24)23-21-20(22(26)28)16(15-30-21)17-7-6-12-29-17/h6-7,12,15H,1-5,8-11,13-14H2/p+1