ethyl 3-[[5-azanyl-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]amino]benzoate

Systemtic Name: ethyl 3-[[5-azanyl-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 3-[[5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]amino]benzoate CAS Name: 3-[[5-amino-6-[(6-methyl-2-pyridinyl)amino]-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[5-amino-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]amino]benzoate Traditional Name: 3-[[5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=N3)C)N

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=N3)C)N

InChI

InChI=1S/C19H20N6O2/c1-3-27-19(26)13-7-5-8-14(10-13)24-17-16(20)18(22-11-21-17)25-15-9-4-6-12(2)23-15/h4-11H,3,20H2,1-2H3,(H2,21,22,23,24,25)