5-(2-butylsulfanylethanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 5-(2-butylsulfanylethanoylamino)thiophene-2-carboxylic acid Openeye Name: 5-[(2-butylsulfanylacetyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[[2-(butylthio)-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-butylsulfanylacetyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[[2-(butylthio)acetyl]amino]-2-thenoic acid Formula: C11H15NO3S2 MolecularWeight: 273.3717

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO3S2/c1-2-3-6-16-7-9(13)12-10-5-4-8(17-10)11(14)15/h4-5H,2-3,6-7H2,1H3,(H,12,13)(H,14,15)