ethyl 2-[2-[(5-carbonochloridoylpyridin-2-yl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-[(5-carbonochloridoylpyridin-2-yl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-[(5-chlorocarbonyl-2-pyridyl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate CAS Name: 2-[2-[(5-carbonochloridoyl-2-pyridinyl)amino]ethylamino]-4-(4-cyanophenyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[(5-carbonochloridoylpyridin-2-yl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate Traditional Name: 2-[2-[(5-chlorocarbonyl-2-pyridyl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C22H19ClN6O3 MolecularWeight: 450.87766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)C#N)NCCNC3=NC=C(C=C3)C(=O)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)C#N)NCCNC3=NC=C(C=C3)C(=O)Cl

InChI

InChI=1S/C22H19ClN6O3/c1-2-32-21(31)17-13-28-22(29-19(17)15-5-3-14(11-24)4-6-15)26-10-9-25-18-8-7-16(12-27-18)20(23)30/h3-8,12-13H,2,9-10H2,1H3,(H,25,27)(H,26,28,29)