1-[(2-acetamido-1,3-thiazol-4-yl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2-acetamido-1,3-thiazol-4-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2-acetamidothiazol-4-yl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2-acetamido-4-thiazolyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2-acetamido-1,3-thiazol-4-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2-acetamidothiazol-4-yl)methyl]nipecotic acid Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CC(=O)NC1=NC(=CS1)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C12H17N3O3S/c1-8(16)13-12-14-10(7-19-12)6-15-4-2-3-9(5-15)11(17)18/h7,9H,2-6H2,1H3,(H,17,18)(H,13,14,16)