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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4S/c1-14(2)11-17(21(27)28)19-13-30-22(24-19)25-20(26)18-10-6-7-15(23-18)12-29-16-8-4-3-5-9-16/h3-10,13-14,17H,11-12H2,1-2H3,(H,27,28)(H,24,25,26)