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

Systemtic Name: 3-[[2-[(3,4-dimethylphenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]propanoic acid Openeye Name: 3-[[2-[(3,4-dimethylbenzoyl)amino]thiazole-4-carbonyl]amino]propanoic acid CAS Name: 3-[[[2-[[(3,4-dimethylphenyl)-oxomethyl]amino]-4-thiazolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(3,4-dimethylbenzoyl)amino]-1,3-thiazole-4-carbonyl]amino]propanoic acid Traditional Name: 3-[[2-[(3,4-dimethylbenzoyl)amino]thiazole-4-carbonyl]amino]propionic acid Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C(=O)NCCC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C(=O)NCCC(=O)O)C

InChI

InChI=1S/C16H17N3O4S/c1-9-3-4-11(7-10(9)2)14(22)19-16-18-12(8-24-16)15(23)17-6-5-13(20)21/h3-4,7-8H,5-6H2,1-2H3,(H,17,23)(H,20,21)(H,18,19,22)