3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methylamino]propanoic acid

Systemtic Name: 3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methylamino]propanoic acid Openeye Name: 3-[[2-(2-chlorophenyl)thiazol-4-yl]methylamino]propanoic acid CAS Name: 3-[[2-(2-chlorophenyl)-4-thiazolyl]methylamino]propanoic acid IUPAC Name: 3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methylamino]propanoic acid Traditional Name: 3-[[2-(2-chlorophenyl)thiazol-4-yl]methylamino]propionic acid Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=CS2)CNCCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=CS2)CNCCC(=O)O)Cl

InChI

InChI=1S/C13H13ClN2O2S/c14-11-4-2-1-3-10(11)13-16-9(8-19-13)7-15-6-5-12(17)18/h1-4,8,15H,5-7H2,(H,17,18)