ethyl 8-(2-bromoethyl)-2-(4-ethanoylpiperazin-1-yl)-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 8-(2-bromoethyl)-2-(4-ethanoylpiperazin-1-yl)-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-(4-acetylpiperazin-1-yl)-8-(2-bromoethyl)-5-oxo-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-(4-acetyl-1-piperazinyl)-8-(2-bromoethyl)-5-oxo-6-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-acetylpiperazin-1-yl)-8-(2-bromoethyl)-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(4-acetylpiperazino)-8-(2-bromoethyl)-5-keto-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H22BrN5O4 MolecularWeight: 452.30238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=NC(=NC=C2C1=O)N3CCN(CC3)C(=O)C)CCBr

Isomeric SMILES

CCOC(=O)C1=CN(C2=NC(=NC=C2C1=O)N3CCN(CC3)C(=O)C)CCBr

InChI

InChI=1S/C18H22BrN5O4/c1-3-28-17(27)14-11-24(5-4-19)16-13(15(14)26)10-20-18(21-16)23-8-6-22(7-9-23)12(2)25/h10-11H,3-9H2,1-2H3