methyl 1-[2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoyl]piperidine-4-carboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

InChI

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