5-(2-tert-butylsulfanylethanoylamino)-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-(2-tert-butylsulfanylethanoylamino)-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(2-tert-butylsulfanylacetyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[2-(tert-butylthio)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-tert-butylsulfanylacetyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[[2-(tert-butylthio)acetyl]amino]-3-methyl-2-thenoic acid Formula: C12H17NO3S2 MolecularWeight: 287.39828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CSC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CSC(C)(C)C)C(=O)O

InChI

InChI=1S/C12H17NO3S2/c1-7-5-9(18-10(7)11(15)16)13-8(14)6-17-12(2,3)4/h5H,6H2,1-4H3,(H,13,14)(H,15,16)