2-[4-oxidanylidene-4-(1,3-thiazol-2-ylamino)butan-2-yl]hexanoic acid

Systemtic Name: 2-[4-oxidanylidene-4-(1,3-thiazol-2-ylamino)butan-2-yl]hexanoic acid Openeye Name: 2-[1-methyl-3-oxo-3-(thiazol-2-ylamino)propyl]hexanoic acid CAS Name: 2-[4-oxo-4-(2-thiazolylamino)butan-2-yl]hexanoic acid IUPAC Name: 2-[4-oxo-4-(1,3-thiazol-2-ylamino)butan-2-yl]hexanoic acid Traditional Name: 2-[3-keto-1-methyl-3-(thiazol-2-ylamino)propyl]hexanoic acid Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC(=O)NC1=NC=CS1)C(=O)O

Isomeric SMILES

CCCCC(C(C)CC(=O)NC1=NC=CS1)C(=O)O

InChI

InChI=1S/C13H20N2O3S/c1-3-4-5-10(12(17)18)9(2)8-11(16)15-13-14-6-7-19-13/h6-7,9-10H,3-5,8H2,1-2H3,(H,17,18)(H,14,15,16)