4-[methyl(2-thiophen-2-ylethylcarbamoyl)amino]butanoic acid

Systemtic Name: 4-[methyl(2-thiophen-2-ylethylcarbamoyl)amino]butanoic acid Openeye Name: 4-[methyl-[2-(2-thienyl)ethylcarbamoyl]amino]butanoic acid CAS Name: 4-[methyl-[oxo-(2-thiophen-2-ylethylamino)methyl]amino]butanoic acid IUPAC Name: 4-[methyl(2-thiophen-2-ylethylcarbamoyl)amino]butanoic acid Traditional Name: 4-[methyl-[2-(2-thienyl)ethylcarbamoyl]amino]butyric acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)NCCC1=CC=CS1

Isomeric SMILES

CN(CCCC(=O)O)C(=O)NCCC1=CC=CS1

InChI

InChI=1S/C12H18N2O3S/c1-14(8-2-5-11(15)16)12(17)13-7-6-10-4-3-9-18-10/h3-4,9H,2,5-8H2,1H3,(H,13,17)(H,15,16)