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

Systemtic Name: ethyl 1-(5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidin-6-yl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(4-keto-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carbonyl)isonipecotic acid ethyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCC(CC3)C(=O)OCC)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCC(CC3)C(=O)OCC)C

InChI

InChI=1S/C19H25N3O4S/c1-4-8-22-11-20-16-14(17(22)23)12(3)15(27-16)18(24)21-9-6-13(7-10-21)19(25)26-5-2/h11,13H,4-10H2,1-3H3