2-[2-[[6-(phenoxymethyl)pyridin-2-yl]carbonylamino]-1,3-thiazol-4-yl]hexanoic acid

Systemtic Name: 2-[2-[[6-(phenoxymethyl)pyridin-2-yl]carbonylamino]-1,3-thiazol-4-yl]hexanoic acid Openeye Name: 2-[2-[[6-(phenoxymethyl)pyridine-2-carbonyl]amino]thiazol-4-yl]hexanoic acid CAS Name: 2-[2-[[oxo-[6-(phenoxymethyl)-2-pyridinyl]methyl]amino]-4-thiazolyl]hexanoic acid IUPAC Name: 2-[2-[[6-(phenoxymethyl)pyridine-2-carbonyl]amino]-1,3-thiazol-4-yl]hexanoic acid Traditional Name: 2-[2-[[6-(phenoxymethyl)picolinoyl]amino]thiazol-4-yl]hexanoic acid Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CSC(=N1)NC(=O)C2=NC(=CC=C2)COC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCC(C1=CSC(=N1)NC(=O)C2=NC(=CC=C2)COC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H23N3O4S/c1-2-3-11-17(21(27)28)19-14-30-22(24-19)25-20(26)18-12-7-8-15(23-18)13-29-16-9-5-4-6-10-16/h4-10,12,14,17H,2-3,11,13H2,1H3,(H,27,28)(H,24,25,26)