(2S,3S)-3-methyl-2-(2-thiophen-2-ylethylcarbamoylamino)pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-(2-thiophen-2-ylethylcarbamoylamino)pentanoate Openeye Name: (2S,3S)-3-methyl-2-[2-(2-thienyl)ethylcarbamoylamino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[oxo-(2-thiophen-2-ylethylamino)methyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-(2-thiophen-2-ylethylcarbamoylamino)pentanoate Traditional Name: (2S,3S)-3-methyl-2-[2-(2-thienyl)ethylcarbamoylamino]valerate Formula: C13H19N2O3S- MolecularWeight: 283.36656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3S/c1-3-9(2)11(12(16)17)15-13(18)14-7-6-10-5-4-8-19-10/h4-5,8-9,11H,3,6-7H2,1-2H3,(H,16,17)(H2,14,15,18)/p-1/t9-,11-/m0/s1