1-[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl]piperidin-4-ol

Systemtic Name: 1-[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl]piperidin-4-ol Openeye Name: 1-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperidin-4-ol CAS Name: 1-[2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl]-4-piperidinol IUPAC Name: 1-[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]piperidin-4-ol Traditional Name: 1-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperidin-4-ol Formula: C20H25N4O2S2+ MolecularWeight: 417.5681

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1O)C2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C20H24N4O2S2/c25-14-3-5-24(6-4-14)19-18-15(16-2-1-11-27-16)13-28-20(18)22-17(21-19)12-23-7-9-26-10-8-23/h1-2,11,13-14,25H,3-10,12H2/p+1