methyl 1-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]isonipecotic acid methyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O4S/c1-27-21(26)15-7-9-24(10-8-15)17(25)11-28-19-18-16(14-5-3-2-4-6-14)12-29-20(18)23-13-22-19/h2-6,12-13,15H,7-11H2,1H3