2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-N-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-N-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-N-(3-pyridylmethyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-(4-morpholin-4-iumylmethyl)-5-phenyl-N-(3-pyridinylmethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-N-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C23H24N5OS+ MolecularWeight: 418.53456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC(=C3C(=CSC3=N2)C4=CC=CC=C4)NCC5=CN=CC=C5

Isomeric SMILES

C1COCC[NH+]1CC2=NC(=C3C(=CSC3=N2)C4=CC=CC=C4)NCC5=CN=CC=C5

InChI

InChI=1S/C23H23N5OS/c1-2-6-18(7-3-1)19-16-30-23-21(19)22(25-14-17-5-4-8-24-13-17)26-20(27-23)15-28-9-11-29-12-10-28/h1-8,13,16H,9-12,14-15H2,(H,25,26,27)/p+1