4,4-dimethyl-2-(2-thiophen-2-ylethanoylamino)pentanoic acid

Systemtic Name: 4,4-dimethyl-2-(2-thiophen-2-ylethanoylamino)pentanoic acid Openeye Name: 4,4-dimethyl-2-[[2-(2-thienyl)acetyl]amino]pentanoic acid CAS Name: 4,4-dimethyl-2-[(1-oxo-2-thiophen-2-ylethyl)amino]pentanoic acid IUPAC Name: 4,4-dimethyl-2-[(2-thiophen-2-ylacetyl)amino]pentanoic acid Traditional Name: 4,4-dimethyl-2-[[2-(2-thienyl)acetyl]amino]valeric acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)O)NC(=O)CC1=CC=CS1

Isomeric SMILES

CC(C)(C)CC(C(=O)O)NC(=O)CC1=CC=CS1

InChI

InChI=1S/C13H19NO3S/c1-13(2,3)8-10(12(16)17)14-11(15)7-9-5-4-6-18-9/h4-6,10H,7-8H2,1-3H3,(H,14,15)(H,16,17)