4-[[2-[(4-methylphenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]butanoic acid

Systemtic Name: 4-[[2-[(4-methylphenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]butanoic acid Openeye Name: 4-[[2-[(4-methylbenzoyl)amino]thiazole-4-carbonyl]amino]butanoic acid CAS Name: 4-[[[2-[[(4-methylphenyl)-oxomethyl]amino]-4-thiazolyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[2-[(4-methylbenzoyl)amino]-1,3-thiazole-4-carbonyl]amino]butanoic acid Traditional Name: 4-[[2-(p-toluoylamino)thiazole-4-carbonyl]amino]butyric acid Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C(=O)NCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C(=O)NCCCC(=O)O

InChI

InChI=1S/C16H17N3O4S/c1-10-4-6-11(7-5-10)14(22)19-16-18-12(9-24-16)15(23)17-8-2-3-13(20)21/h4-7,9H,2-3,8H2,1H3,(H,17,23)(H,20,21)(H,18,19,22)