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

Systemtic Name: 4-[[2-[(3-methylphenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]butanoate Openeye Name: 4-[[2-[(3-methylbenzoyl)amino]thiazole-4-carbonyl]amino]butanoate CAS Name: 4-[[[2-[[(3-methylphenyl)-oxomethyl]amino]-4-thiazolyl]-oxomethyl]amino]butanoate IUPAC Name: 4-[[2-[(3-methylbenzoyl)amino]-1,3-thiazole-4-carbonyl]amino]butanoate Traditional Name: 4-[[2-(m-toluoylamino)thiazole-4-carbonyl]amino]butyrate Formula: C16H16N3O4S- MolecularWeight: 346.38094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O4S/c1-10-4-2-5-11(8-10)14(22)19-16-18-12(9-24-16)15(23)17-7-3-6-13(20)21/h2,4-5,8-9H,3,6-7H2,1H3,(H,17,23)(H,20,21)(H,18,19,22)/p-1