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

Systemtic Name: 5,6-dimethyl-N-(3-morpholin-4-ylpropyl)-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine; ethanedioic acid Openeye Name: 5,6-dimethyl-N-(3-morpholinopropyl)-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine; oxalic acid CAS Name: 5,6-dimethyl-N-[3-(4-morpholinyl)propyl]-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine; oxalic acid IUPAC Name: 5,6-dimethyl-N-(3-morpholin-4-ylpropyl)-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine; oxalic acid Traditional Name: [5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-(3-morpholinopropyl)amine; oxalic acid Formula: C22H27N5O5S MolecularWeight: 473.54528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCCN3CCOCC3)C4=CN=CC=C4)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCCN3CCOCC3)C4=CN=CC=C4)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25N5OS.C2H2O4/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;3-1(4)2(5)6/h3,5-6,13H,4,7-12H2,1-2H3,(H,22,23,24);(H,3,4)(H,5,6)