2-[2-[(3-cyanophenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(3-cyanophenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(3-cyanobenzoyl)amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[(3-cyanophenyl)-oxomethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(3-cyanobenzoyl)amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(3-cyanobenzoyl)amino]thiazol-4-yl]acetic acid Formula: C13H9N3O3S MolecularWeight: 287.29386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=NC(=CS2)CC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=NC(=CS2)CC(=O)O)C#N

InChI

InChI=1S/C13H9N3O3S/c14-6-8-2-1-3-9(4-8)12(19)16-13-15-10(7-20-13)5-11(17)18/h1-4,7H,5H2,(H,17,18)(H,15,16,19)