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

Systemtic Name: (2R)-1-[[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl]amino]propan-2-ol Openeye Name: (2R)-1-[[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]propan-2-ol CAS Name: (2R)-1-[[2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl]amino]-2-propanol IUPAC Name: (2R)-1-[[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]amino]propan-2-ol Traditional Name: (2R)-1-[[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]propan-2-ol Formula: C18H23N4O2S2+ MolecularWeight: 391.53082

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4)O

Isomeric SMILES

C[C@H](CNC1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4)O

InChI

InChI=1S/C18H22N4O2S2/c1-12(23)9-19-17-16-13(14-3-2-8-25-14)11-26-18(16)21-15(20-17)10-22-4-6-24-7-5-22/h2-3,8,11-12,23H,4-7,9-10H2,1H3,(H,19,20,21)/p+1/t12-/m1/s1