(2S)-4-methyl-2-(2-thiophen-2-ylethylcarbamoylamino)pentanoate

Systemtic Name: (2S)-4-methyl-2-(2-thiophen-2-ylethylcarbamoylamino)pentanoate Openeye Name: (2S)-4-methyl-2-[2-(2-thienyl)ethylcarbamoylamino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-(2-thiophen-2-ylethylamino)methyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-(2-thiophen-2-ylethylcarbamoylamino)pentanoate Traditional Name: (2S)-4-methyl-2-[2-(2-thienyl)ethylcarbamoylamino]valerate Formula: C13H19N2O3S- MolecularWeight: 283.36656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)NCCC1=CC=CS1

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)NCCC1=CC=CS1

InChI

InChI=1S/C13H20N2O3S/c1-9(2)8-11(12(16)17)15-13(18)14-6-5-10-4-3-7-19-10/h3-4,7,9,11H,5-6,8H2,1-2H3,(H,16,17)(H2,14,15,18)/p-1/t11-/m0/s1