2-(2-butylsulfanylethanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 2-(2-butylsulfanylethanoylamino)thiophene-3-carboxylic acid Openeye Name: 2-[(2-butylsulfanylacetyl)amino]thiophene-3-carboxylic acid CAS Name: 2-[[2-(butylthio)-1-oxoethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[(2-butylsulfanylacetyl)amino]thiophene-3-carboxylic acid Traditional Name: 2-[[2-(butylthio)acetyl]amino]-3-thenoic acid Formula: C11H15NO3S2 MolecularWeight: 273.3717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=C(C=CS1)C(=O)O

Isomeric SMILES

CCCCSCC(=O)NC1=C(C=CS1)C(=O)O

InChI

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