ethyl 4-[(2-bromophenyl)amino]-2-ethoxy-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(2-bromophenyl)amino]-2-ethoxy-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-bromoanilino)-2-ethoxy-pyrimidine-5-carboxylate CAS Name: 4-(2-bromoanilino)-2-ethoxy-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-bromoanilino)-2-ethoxypyrimidine-5-carboxylate Traditional Name: 4-(2-bromoanilino)-2-ethoxy-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H16BrN3O3 MolecularWeight: 366.20984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=C(C(=N1)NC2=CC=CC=C2Br)C(=O)OCC

Isomeric SMILES

CCOC1=NC=C(C(=N1)NC2=CC=CC=C2Br)C(=O)OCC

InChI

InChI=1S/C15H16BrN3O3/c1-3-21-14(20)10-9-17-15(22-4-2)19-13(10)18-12-8-6-5-7-11(12)16/h5-9H,3-4H2,1-2H3,(H,17,18,19)