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

Systemtic Name: 3,3-dimethyl-2-[3-(thiophen-3-ylcarbonylamino)propanoylamino]butanoic acid Openeye Name: 3,3-dimethyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]butanoic acid CAS Name: 3,3-dimethyl-2-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]butanoic acid Traditional Name: 3,3-dimethyl-2-[3-(3-thenoylamino)propanoylamino]butyric acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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