4-[(2S)-2-ethylpiperidin-1-yl]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 4-[(2S)-2-ethylpiperidin-1-yl]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-[(2S)-2-ethyl-1-piperidyl]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-[(2S)-2-ethyl-1-piperidinyl]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-[(2S)-2-ethylpiperidin-1-yl]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-[(2S)-2-ethylpiperidino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C3C(=C(SC3=NC(=N2)C)C(=O)O)C

Isomeric SMILES

CC[C@H]1CCCCN1C2=C3C(=C(SC3=NC(=N2)C)C(=O)O)C

InChI

InChI=1S/C16H21N3O2S/c1-4-11-7-5-6-8-19(11)14-12-9(2)13(16(20)21)22-15(12)18-10(3)17-14/h11H,4-8H2,1-3H3,(H,20,21)/t11-/m0/s1