6-oxidanyl-5-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-oxidanyl-5-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-hydroxy-5-(piperidin-1-ium-1-ylmethyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-hydroxy-5-(1-piperidin-1-iumylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-hydroxy-5-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-hydroxy-5-(piperidin-1-ium-1-ylmethyl)-2-thioxo-1H-pyrimidin-4-one Formula: C10H16N3O2S+ MolecularWeight: 242.31794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(NC(=S)NC2=O)O

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(NC(=S)NC2=O)O

InChI

InChI=1S/C10H15N3O2S/c14-8-7(9(15)12-10(16)11-8)6-13-4-2-1-3-5-13/h1-6H2,(H3,11,12,14,15,16)/p+1