(2S,3S)-3-methyl-2-(4-thiophen-2-ylbutanoylamino)pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-(4-thiophen-2-ylbutanoylamino)pentanoate Openeye Name: (2S,3S)-3-methyl-2-[4-(2-thienyl)butanoylamino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[(1-oxo-4-thiophen-2-ylbutyl)amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-(4-thiophen-2-ylbutanoylamino)pentanoate Traditional Name: (2S,3S)-3-methyl-2-[4-(2-thienyl)butanoylamino]valerate Formula: C14H20NO3S- MolecularWeight: 282.3785

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CCCC1=CC=CS1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)CCCC1=CC=CS1

InChI

InChI=1S/C14H21NO3S/c1-3-10(2)13(14(17)18)15-12(16)8-4-6-11-7-5-9-19-11/h5,7,9-10,13H,3-4,6,8H2,1-2H3,(H,15,16)(H,17,18)/p-1/t10-,13-/m0/s1