[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 5-bromanylthiophene-2-carboxylate

Systemtic Name: [2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 5-bromanylthiophene-2-carboxylate Openeye Name: [2-(3-ethylanilino)-2-oxo-ethyl] 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [2-(3-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylanilino)-2-oxoethyl] 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [2-(3-ethylanilino)-2-keto-ethyl] ester Formula: C15H14BrNO3S MolecularWeight: 368.24556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)COC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)COC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H14BrNO3S/c1-2-10-4-3-5-11(8-10)17-14(18)9-20-15(19)12-6-7-13(16)21-12/h3-8H,2,9H2,1H3,(H,17,18)