3-[[2-[(2-fluorophenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[2-[(2-fluorophenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]propanoic acid Openeye Name: 3-[[2-[(2-fluorobenzoyl)amino]thiazole-4-carbonyl]amino]propanoic acid CAS Name: 3-[[[2-[[(2-fluorophenyl)-oxomethyl]amino]-4-thiazolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(2-fluorobenzoyl)amino]-1,3-thiazole-4-carbonyl]amino]propanoic acid Traditional Name: 3-[[2-[(2-fluorobenzoyl)amino]thiazole-4-carbonyl]amino]propionic acid Formula: C14H12FN3O4S MolecularWeight: 337.326183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NC(=CS2)C(=O)NCCC(=O)O)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC(=CS2)C(=O)NCCC(=O)O)F

InChI

InChI=1S/C14H12FN3O4S/c15-9-4-2-1-3-8(9)12(21)18-14-17-10(7-23-14)13(22)16-6-5-11(19)20/h1-4,7H,5-6H2,(H,16,22)(H,19,20)(H,17,18,21)