ethyl 1-[2-(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]piperidine-3-carboxylate CAS Name: 1-[2-(5-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(5-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]nipecotic acid ethyl ester Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H25N3O4S/c1-3-30-23(29)17-10-7-11-25(12-17)18(27)13-26-14-24-21-19(22(26)28)15(2)20(31-21)16-8-5-4-6-9-16/h4-6,8-9,14,17H,3,7,10-13H2,1-2H3