methyl 3-(1-bromanylbutan-2-ylcarbamoylamino)-5-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-(1-bromanylbutan-2-ylcarbamoylamino)-5-methyl-thiophene-2-carboxylate Openeye Name: methyl 3-[1-(bromomethyl)propylcarbamoylamino]-5-methyl-thiophene-2-carboxylate CAS Name: 3-[[(1-bromobutan-2-ylamino)-oxomethyl]amino]-5-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(1-bromobutan-2-ylcarbamoylamino)-5-methylthiophene-2-carboxylate Traditional Name: 3-[1-(bromomethyl)propylcarbamoylamino]-5-methyl-thiophene-2-carboxylic acid methyl ester Formula: C12H17BrN2O3S MolecularWeight: 349.24398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CBr)NC(=O)NC1=C(SC(=C1)C)C(=O)OC

Isomeric SMILES

CCC(CBr)NC(=O)NC1=C(SC(=C1)C)C(=O)OC

InChI

InChI=1S/C12H17BrN2O3S/c1-4-8(6-13)14-12(17)15-9-5-7(2)19-10(9)11(16)18-3/h5,8H,4,6H2,1-3H3,(H2,14,15,17)