[(2R)-1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-ethyl-5-methyl-thiophene-2-carboxylate

Systemtic Name: [(2R)-1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-ethyl-5-methyl-thiophene-2-carboxylate Openeye Name: [(1R)-2-(4-bromo-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] 4-ethyl-5-methyl-thiophene-2-carboxylate CAS Name: 4-ethyl-5-methyl-2-thiophenecarboxylic acid [(2R)-1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] 4-ethyl-5-methylthiophene-2-carboxylate Traditional Name: 4-ethyl-5-methyl-thiophene-2-carboxylic acid [(1R)-2-(4-bromo-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C17H17BrFNO3S MolecularWeight: 414.289183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)OC(C)C(=O)NC2=C(C=C(C=C2)Br)F)C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)O[C@H](C)C(=O)NC2=C(C=C(C=C2)Br)F)C

InChI

InChI=1S/C17H17BrFNO3S/c1-4-11-7-15(24-10(11)3)17(22)23-9(2)16(21)20-14-6-5-12(18)8-13(14)19/h5-9H,4H2,1-3H3,(H,20,21)/t9-/m1/s1