1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C19H21N4O2S+ MolecularWeight: 369.46064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C19H20N4O2S/c24-18(20-14-4-2-1-3-5-14)13-6-9-23(10-7-13)12-16-21-15-8-11-26-17(15)19(25)22-16/h1-5,8,11,13H,6-7,9-10,12H2,(H,20,24)(H,21,22,25)/p+1