3-methyl-2-[2-(thiophen-2-ylcarbonylamino)propanoylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[2-(thiophen-2-ylcarbonylamino)propanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[2-(thiophene-2-carbonylamino)propanoylamino]pentanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]propyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[2-(thiophene-2-carbonylamino)propanoylamino]pentanoic acid Traditional Name: 3-methyl-2-[2-(2-thenoylamino)propanoylamino]valeric acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4S/c1-4-8(2)11(14(19)20)16-12(17)9(3)15-13(18)10-6-5-7-21-10/h5-9,11H,4H2,1-3H3,(H,15,18)(H,16,17)(H,19,20)