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

Systemtic Name: ethyl 1-(3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate CAS Name: 1-[(3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)nipecotic acid ethyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)C)C

InChI

InChI=1S/C17H21N3O4S/c1-4-24-17(23)11-6-5-7-20(8-11)16(22)13-10(2)12-14(25-13)18-9-19(3)15(12)21/h9,11H,4-8H2,1-3H3