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

Systemtic Name: 2-[(2-phenylazanyl-1,3-thiazol-4-yl)carbonylamino]propanoic acid Openeye Name: 2-[(2-anilinothiazole-4-carbonyl)amino]propanoic acid CAS Name: 2-[[(2-anilino-4-thiazolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(2-anilino-1,3-thiazole-4-carbonyl)amino]propanoic acid Traditional Name: 2-[(2-anilinothiazole-4-carbonyl)amino]propionic acid Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CSC(=N1)NC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=CSC(=N1)NC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3S/c1-8(12(18)19)14-11(17)10-7-20-13(16-10)15-9-5-3-2-4-6-9/h2-8H,1H3,(H,14,17)(H,15,16)(H,18,19)