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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)CCCC(=O)NCCCC(=O)O

InChI

InChI=1S/C12H17NO3S/c14-11(13-8-2-7-12(15)16)6-1-4-10-5-3-9-17-10/h3,5,9H,1-2,4,6-8H2,(H,13,14)(H,15,16)