[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 5-bromanylthiophene-2-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 5-bromanylthiophene-2-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C11H14BrNO3S MolecularWeight: 320.20276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC=C(S1)Br

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=CC=C(S1)Br

InChI

InChI=1S/C11H14BrNO3S/c1-3-7(2)13-10(14)6-16-11(15)8-4-5-9(12)17-8/h4-5,7H,3,6H2,1-2H3,(H,13,14)