3-methyl-2-[[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid Traditional Name: 2-[[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]amino]-3-methyl-butyric acid Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)NCCC1=CC=CS1

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)NCCC1=CC=CS1

InChI

InChI=1S/C13H20N2O3S/c1-9(2)12(13(17)18)15-8-11(16)14-6-5-10-4-3-7-19-10/h3-4,7,9,12,15H,5-6,8H2,1-2H3,(H,14,16)(H,17,18)