1-(4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidin-2-yl)piperidine-4-carboxylate

Systemtic Name: 1-(4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidin-2-yl)piperidine-4-carboxylate Openeye Name: 1-[4-oxo-6-(2-thienyl)-1H-pyrimidin-2-yl]piperidine-4-carboxylate CAS Name: 1-(4-oxo-6-thiophen-2-yl-1H-pyrimidin-2-yl)-4-piperidinecarboxylate IUPAC Name: 1-(4-oxo-6-thiophen-2-yl-1H-pyrimidin-2-yl)piperidine-4-carboxylate Traditional Name: 1-[4-keto-6-(2-thienyl)-1H-pyrimidin-2-yl]isonipecotate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=NC(=O)C=C(N2)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=NC(=O)C=C(N2)C3=CC=CS3

InChI

InChI=1S/C14H15N3O3S/c18-12-8-10(11-2-1-7-21-11)15-14(16-12)17-5-3-9(4-6-17)13(19)20/h1-2,7-9H,3-6H2,(H,19,20)(H,15,16,18)/p-1