ethyl 2-(2-azanyl-4-chloranyl-pyrimidin-5-yl)-2-ethyl-butanoate

Systemtic Name: ethyl 2-(2-azanyl-4-chloranyl-pyrimidin-5-yl)-2-ethyl-butanoate Openeye Name: ethyl 2-(2-amino-4-chloro-pyrimidin-5-yl)-2-ethyl-butanoate CAS Name: 2-(2-amino-4-chloro-5-pyrimidinyl)-2-ethylbutanoic acid ethyl ester IUPAC Name: ethyl 2-(2-amino-4-chloropyrimidin-5-yl)-2-ethylbutanoate Traditional Name: 2-(2-amino-4-chloro-pyrimidin-5-yl)-2-ethyl-butyric acid ethyl ester Formula: C12H18ClN3O2 MolecularWeight: 271.74322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CN=C(N=C1Cl)N)C(=O)OCC

Isomeric SMILES

CCC(CC)(C1=CN=C(N=C1Cl)N)C(=O)OCC

InChI

InChI=1S/C12H18ClN3O2/c1-4-12(5-2,10(17)18-6-3)8-7-15-11(14)16-9(8)13/h7H,4-6H2,1-3H3,(H2,14,15,16)