ethyl 4-[2-cyanoethyl(2-morpholin-4-ylethyl)amino]-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-cyanoethyl(2-morpholin-4-ylethyl)amino]-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-cyanoethyl(2-morpholinoethyl)amino]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[2-cyanoethyl-[2-(4-morpholinyl)ethyl]amino]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-cyanoethyl(2-morpholin-4-ylethyl)amino]-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[2-cyanoethyl(2-morpholinoethyl)amino]-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N(CCC#N)CCN2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N(CCC#N)CCN2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H27N5O3/c1-2-30-22(28)19-17-24-20(18-7-4-3-5-8-18)25-21(19)27(10-6-9-23)12-11-26-13-15-29-16-14-26/h3-5,7-8,17H,2,6,10-16H2,1H3