(3R)-1-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C19H21N4O2S+ MolecularWeight: 369.46064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2)C(=O)N

InChI

InChI=1S/C19H20N4O2S/c20-17(24)13-7-4-8-23(9-13)10-15-21-18(25)16-14(11-26-19(16)22-15)12-5-2-1-3-6-12/h1-3,5-6,11,13H,4,7-10H2,(H2,20,24)(H,21,22,25)/p+1/t13-/m1/s1