2-(2-formamido-1,3-thiazol-4-yl)-2-[[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-but-2-enoxy]amino]ethanoic acid

Systemtic Name: 2-(2-formamido-1,3-thiazol-4-yl)-2-[[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-but-2-enoxy]amino]ethanoic acid Openeye Name: 2-[[(E)-4-tert-butoxy-4-oxo-but-2-enoxy]amino]-2-(2-formamidothiazol-4-yl)acetic acid CAS Name: 2-(2-formamido-4-thiazolyl)-2-[[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoxy]amino]acetic acid IUPAC Name: 2-(2-formamido-1,3-thiazol-4-yl)-2-[[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoxy]amino]acetic acid Traditional Name: 2-[[(E)-4-tert-butoxy-4-keto-but-2-enoxy]amino]-2-(2-formamidothiazol-4-yl)acetic acid Formula: C14H19N3O6S MolecularWeight: 357.38216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CCONC(C1=CSC(=N1)NC=O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/CONC(C1=CSC(=N1)NC=O)C(=O)O

InChI

InChI=1S/C14H19N3O6S/c1-14(2,3)23-10(19)5-4-6-22-17-11(12(20)21)9-7-24-13(16-9)15-8-18/h4-5,7-8,11,17H,6H2,1-3H3,(H,20,21)(H,15,16,18)/b5-4+