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

Systemtic Name: 1-[(4-methyl-1,3-thiazol-2-yl)-pyridin-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-methylthiazol-2-yl)-(2-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methyl-2-thiazolyl)-(2-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methyl-1,3-thiazol-2-yl)-pyridin-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-methylthiazol-2-yl)-(2-pyridyl)methyl]isonipecotic acid Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C2=CC=CC=N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CSC(=N1)C(C2=CC=CC=N2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H19N3O2S/c1-11-10-22-15(18-11)14(13-4-2-3-7-17-13)19-8-5-12(6-9-19)16(20)21/h2-4,7,10,12,14H,5-6,8-9H2,1H3,(H,20,21)