5-[3-(2,2-dimethylpropanoylamino)propanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(2,2-dimethylpropanoylamino)propanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-[3-(2,2-dimethylpropanoylamino)propanoylamino]thiophene-2-carboxylic acid CAS Name: 5-[[3-[(2,2-dimethyl-1-oxopropyl)amino]-1-oxopropyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(2,2-dimethylpropanoylamino)propanoylamino]thiophene-2-carboxylic acid Traditional Name: 5-[3-(pivaloylamino)propanoylamino]-2-thenoic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCCC(=O)NC1=CC=C(S1)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NCCC(=O)NC1=CC=C(S1)C(=O)O

InChI

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