3-(4-thiophen-2-ylbutanoylamino)butanoic acid

Systemtic Name: 3-(4-thiophen-2-ylbutanoylamino)butanoic acid Openeye Name: 3-[4-(2-thienyl)butanoylamino]butanoic acid CAS Name: 3-[(1-oxo-4-thiophen-2-ylbutyl)amino]butanoic acid IUPAC Name: 3-(4-thiophen-2-ylbutanoylamino)butanoic acid Traditional Name: 3-[4-(2-thienyl)butanoylamino]butyric acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)CCCC1=CC=CS1

Isomeric SMILES

CC(CC(=O)O)NC(=O)CCCC1=CC=CS1

InChI

InChI=1S/C12H17NO3S/c1-9(8-12(15)16)13-11(14)6-2-4-10-5-3-7-17-10/h3,5,7,9H,2,4,6,8H2,1H3,(H,13,14)(H,15,16)