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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])NC(=O)C1=CSC(=N1)NC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CC[C@@H](C(=O)[O-])NC(=O)C1=CSC(=N1)NC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C16H17N3O4S/c1-3-11(15(22)23)17-14(21)12-8-24-16(18-12)19-13(20)10-6-4-5-9(2)7-10/h4-8,11H,3H2,1-2H3,(H,17,21)(H,22,23)(H,18,19,20)/p-1/t11-/m0/s1