6-[[2-(2-methylpropanoylamino)-1,3-thiazol-4-yl]carbonylamino]hexanoate

Systemtic Name: 6-[[2-(2-methylpropanoylamino)-1,3-thiazol-4-yl]carbonylamino]hexanoate Openeye Name: 6-[[2-(2-methylpropanoylamino)thiazole-4-carbonyl]amino]hexanoate CAS Name: 6-[[[2-[(2-methyl-1-oxopropyl)amino]-4-thiazolyl]-oxomethyl]amino]hexanoate IUPAC Name: 6-[[2-(2-methylpropanoylamino)-1,3-thiazole-4-carbonyl]amino]hexanoate Traditional Name: 6-[[2-(isobutyrylamino)thiazole-4-carbonyl]amino]hexanoate Formula: C14H20N3O4S- MolecularWeight: 326.3913

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC(=CS1)C(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC1=NC(=CS1)C(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C14H21N3O4S/c1-9(2)12(20)17-14-16-10(8-22-14)13(21)15-7-5-3-4-6-11(18)19/h8-9H,3-7H2,1-2H3,(H,15,21)(H,18,19)(H,16,17,20)/p-1