2-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 2-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 2-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]amino]hexanoic acid CAS Name: 2-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 2-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 2-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]amino]hexanoic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C=CC1=CSC(=N1)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)/C=C/C1=CSC(=N1)C

InChI

InChI=1S/C13H18N2O3S/c1-3-4-5-11(13(17)18)15-12(16)7-6-10-8-19-9(2)14-10/h6-8,11H,3-5H2,1-2H3,(H,15,16)(H,17,18)/b7-6+