3-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoic acid

Systemtic Name: 3-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoic acid Openeye Name: 3-[(4-phenylthiazol-2-yl)amino]butanoic acid CAS Name: 3-[(4-phenyl-2-thiazolyl)amino]butanoic acid IUPAC Name: 3-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoic acid Traditional Name: 3-[(4-phenylthiazol-2-yl)amino]butyric acid Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC1=NC(=CS1)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)O)NC1=NC(=CS1)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-9(7-12(16)17)14-13-15-11(8-18-13)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H,14,15)(H,16,17)