ethyl 3-[2-azanyl-4-(2-chloranylpyridin-4-yl)pyrimidin-5-yl]benzoate

Systemtic Name: ethyl 3-[2-azanyl-4-(2-chloranylpyridin-4-yl)pyrimidin-5-yl]benzoate Openeye Name: ethyl 3-[2-amino-4-(2-chloro-4-pyridyl)pyrimidin-5-yl]benzoate CAS Name: 3-[2-amino-4-(2-chloro-4-pyridinyl)-5-pyrimidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-amino-4-(2-chloropyridin-4-yl)pyrimidin-5-yl]benzoate Traditional Name: 3-[2-amino-4-(2-chloro-4-pyridyl)pyrimidin-5-yl]benzoic acid ethyl ester Formula: C18H15ClN4O2 MolecularWeight: 354.7903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=CN=C(N=C2C3=CC(=NC=C3)Cl)N

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=CN=C(N=C2C3=CC(=NC=C3)Cl)N

InChI

InChI=1S/C18H15ClN4O2/c1-2-25-17(24)13-5-3-4-11(8-13)14-10-22-18(20)23-16(14)12-6-7-21-15(19)9-12/h3-10H,2H2,1H3,(H2,20,22,23)