4-methyl-2-(3-thiophen-2-ylpropanoylamino)pentanoic acid

Systemtic Name: 4-methyl-2-(3-thiophen-2-ylpropanoylamino)pentanoic acid Openeye Name: 4-methyl-2-[3-(2-thienyl)propanoylamino]pentanoic acid CAS Name: 4-methyl-2-[(1-oxo-3-thiophen-2-ylpropyl)amino]pentanoic acid IUPAC Name: 4-methyl-2-(3-thiophen-2-ylpropanoylamino)pentanoic acid Traditional Name: 4-methyl-2-[3-(2-thienyl)propanoylamino]valeric acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CCC1=CC=CS1

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CCC1=CC=CS1

InChI

InChI=1S/C13H19NO3S/c1-9(2)8-11(13(16)17)14-12(15)6-5-10-4-3-7-18-10/h3-4,7,9,11H,5-6,8H2,1-2H3,(H,14,15)(H,16,17)