2-[(4-carboxypiperidin-1-yl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 2-[(4-carboxypiperidin-1-yl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 2-[(4-carboxy-1-piperidyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2-[(4-carboxy-1-piperidinyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid IUPAC Name: 2-[(4-carboxypiperidin-1-yl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 2-[(4-carboxypiperidino)methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCC(CC3)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCC(CC3)C(=O)O)C(=O)O

InChI

InChI=1S/C15H17N3O5S/c1-7-10-12(19)16-9(17-13(10)24-11(7)15(22)23)6-18-4-2-8(3-5-18)14(20)21/h8H,2-6H2,1H3,(H,20,21)(H,22,23)(H,16,17,19)