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

Systemtic Name: methyl 1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonyl-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)-4-phenylpiperidine-4-carboxylate Traditional Name: 1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)-4-phenyl-isonipecotic acid methyl ester Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C(SC2=N1)C(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)OC)C)C

Isomeric SMILES

CCC1=NC(=C2C(=C(SC2=N1)C(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)OC)C)C

InChI

InChI=1S/C24H27N3O3S/c1-5-18-25-16(3)19-15(2)20(31-21(19)26-18)22(28)27-13-11-24(12-14-27,23(29)30-4)17-9-7-6-8-10-17/h6-10H,5,11-14H2,1-4H3