N-(1-ethylpiperidin-1-ium-4-yl)-5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1-ethyl-4-piperidin-1-iumyl)-5-phenyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (1-ethylpiperidin-1-ium-4-yl)-[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C24H26N5S+ MolecularWeight: 416.56174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=C3C(=CSC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=C3C(=CSC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N5S/c1-2-29-13-10-19(11-14-29)26-23-21-20(17-7-4-3-5-8-17)16-30-24(21)28-22(27-23)18-9-6-12-25-15-18/h3-9,12,15-16,19H,2,10-11,13-14H2,1H3,(H,26,27,28)/p+1