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

Systemtic Name: ethyl 2-[2-[(5-azanylpyridin-2-yl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-[(5-amino-2-pyridyl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate CAS Name: 2-[2-[(5-amino-2-pyridinyl)amino]ethylamino]-4-(4-cyanophenyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[(5-aminopyridin-2-yl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylate Traditional Name: 2-[2-[(5-amino-2-pyridyl)amino]ethylamino]-4-(4-cyanophenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C21H21N7O2 MolecularWeight: 403.43714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N7O2/c1-2-30-20(29)17-13-27-21(25-10-9-24-18-8-7-16(23)12-26-18)28-19(17)15-5-3-14(11-22)4-6-15/h3-8,12-13H,2,9-10,23H2,1H3,(H,24,26)(H,25,27,28)