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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO3S/c1-10(2)9-12(14(17)18)15-13(16)7-3-5-11-6-4-8-19-11/h4,6,8,10,12H,3,5,7,9H2,1-2H3,(H,15,16)(H,17,18)/p-1/t12-/m0/s1