ethyl 1-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylethanoyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylethanoyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylacetyl)piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(4-thieno[3,2-d]pyrimidinylthio)ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylacetyl)piperidine-4-carboxylate Traditional Name: 1-[2-(thieno[3,2-d]pyrimidin-4-ylthio)acetyl]isonipecotic acid ethyl ester Formula: C16H19N3O3S2 MolecularWeight: 365.47036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC=NC3=C2SC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC=NC3=C2SC=C3

InChI

InChI=1S/C16H19N3O3S2/c1-2-22-16(21)11-3-6-19(7-4-11)13(20)9-24-15-14-12(5-8-23-14)17-10-18-15/h5,8,10-11H,2-4,6-7,9H2,1H3