5,6-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-N-[3-(4-morpholin-4-iumyl)propyl]-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C20H26N5OS+ MolecularWeight: 384.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCC[NH+]3CCOCC3)C4=CN=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCC[NH+]3CCOCC3)C4=CN=CC=C4)C

InChI

InChI=1S/C20H25N5OS/c1-14-15(2)27-20-17(14)19(22-7-4-8-25-9-11-26-12-10-25)23-18(24-20)16-5-3-6-21-13-16/h3,5-6,13H,4,7-12H2,1-2H3,(H,22,23,24)/p+1