N-(2-methoxyethyl)-2-[4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-[4-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-(2-methoxyethyl)-2-[4-oxo-2-(piperidin-1-ium-1-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-(2-methoxyethyl)-2-[4-oxo-2-(1-piperidin-1-iumylmethyl)-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-(2-methoxyethyl)-2-[4-oxo-2-(piperidin-1-ium-1-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: 2-[4-keto-2-(piperidin-1-ium-1-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]-N-(2-methoxyethyl)acetamide Formula: C21H27N4O3S2+ MolecularWeight: 447.59408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CN1C(=NC2=C(C1=O)C(=CS2)C3=CC=CS3)C[NH+]4CCCCC4

Isomeric SMILES

COCCNC(=O)CN1C(=NC2=C(C1=O)C(=CS2)C3=CC=CS3)C[NH+]4CCCCC4

InChI

InChI=1S/C21H26N4O3S2/c1-28-10-7-22-18(26)13-25-17(12-24-8-3-2-4-9-24)23-20-19(21(25)27)15(14-30-20)16-6-5-11-29-16/h5-6,11,14H,2-4,7-10,12-13H2,1H3,(H,22,26)/p+1