3-[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[2-(3-bromophenyl)thiazol-4-yl]acetyl]amino]propanoic acid CAS Name: 3-[[2-[2-(3-bromophenyl)-4-thiazolyl]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[2-(3-bromophenyl)thiazol-4-yl]acetyl]amino]propionic acid Formula: C14H13BrN2O3S MolecularWeight: 369.23362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NC(=CS2)CC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NC(=CS2)CC(=O)NCCC(=O)O

InChI

InChI=1S/C14H13BrN2O3S/c15-10-3-1-2-9(6-10)14-17-11(8-21-14)7-12(18)16-5-4-13(19)20/h1-3,6,8H,4-5,7H2,(H,16,18)(H,19,20)