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

Systemtic Name: ethyl 1-[2-(4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(4-oxo-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetyl]isonipecotic acid ethyl ester Formula: C20H21N3O4S2 MolecularWeight: 431.52844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CS4

InChI

InChI=1S/C20H21N3O4S2/c1-2-27-20(26)13-5-7-22(8-6-13)16(24)10-23-12-21-18-17(19(23)25)14(11-29-18)15-4-3-9-28-15/h3-4,9,11-13H,2,5-8,10H2,1H3