2-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]pentanoic acid

Systemtic Name: 2-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]pentanoic acid Openeye Name: 2-[[3-acetamido-3-(2-thienyl)propanoyl]amino]pentanoic acid CAS Name: 2-[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)amino]pentanoic acid IUPAC Name: 2-[(3-acetamido-3-thiophen-2-ylpropanoyl)amino]pentanoic acid Traditional Name: 2-[[3-acetamido-3-(2-thienyl)propanoyl]amino]valeric acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)CC(C1=CC=CS1)NC(=O)C

Isomeric SMILES

CCCC(C(=O)O)NC(=O)CC(C1=CC=CS1)NC(=O)C

InChI

InChI=1S/C14H20N2O4S/c1-3-5-10(14(19)20)16-13(18)8-11(15-9(2)17)12-6-4-7-21-12/h4,6-7,10-11H,3,5,8H2,1-2H3,(H,15,17)(H,16,18)(H,19,20)