ethyl 4-[(2-azanylpyrimidin-4-yl)amino]benzoate

Systemtic Name: ethyl 4-[(2-azanylpyrimidin-4-yl)amino]benzoate Openeye Name: ethyl 4-[(2-aminopyrimidin-4-yl)amino]benzoate CAS Name: 4-[(2-amino-4-pyrimidinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-aminopyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(2-aminopyrimidin-4-yl)amino]benzoic acid ethyl ester Formula: C13H14N4O2 MolecularWeight: 258.27586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC=C2)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC=C2)N

InChI

InChI=1S/C13H14N4O2/c1-2-19-12(18)9-3-5-10(6-4-9)16-11-7-8-15-13(14)17-11/h3-8H,2H2,1H3,(H3,14,15,16,17)