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

Systemtic Name: 1-[(5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-6-yl)carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-6-yl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carbonyl)isonipecotic acid Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC=N2)C(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC=N2)C(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C14H15N3O4S/c1-7-9-11(18)15-6-16-12(9)22-10(7)13(19)17-4-2-8(3-5-17)14(20)21/h6,8H,2-5H2,1H3,(H,20,21)(H,15,16,18)