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

Systemtic Name: 3-methyl-2-[3-(thiophen-3-ylcarbonylamino)propanoylamino]butanoic acid Openeye Name: 3-methyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]butanoic acid CAS Name: 3-methyl-2-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]butanoic acid Traditional Name: 3-methyl-2-[3-(3-thenoylamino)propanoylamino]butyric acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCNC(=O)C1=CSC=C1

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CCNC(=O)C1=CSC=C1

InChI

InChI=1S/C13H18N2O4S/c1-8(2)11(13(18)19)15-10(16)3-5-14-12(17)9-4-6-20-7-9/h4,6-8,11H,3,5H2,1-2H3,(H,14,17)(H,15,16)(H,18,19)