ethyl 1-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]isonipecotic acid ethyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC2=C3C=C(SC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC2=C3C=C(SC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O4S/c1-2-28-22(27)16-8-10-25(11-9-16)19(26)13-29-20-17-12-18(15-6-4-3-5-7-15)30-21(17)24-14-23-20/h3-7,12,14,16H,2,8-11,13H2,1H3