ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloranyl-pyrimidin-4-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloranyl-pyrimidin-4-yl]amino]ethanoate Openeye Name: ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloro-pyrimidin-4-yl]amino]acetate CAS Name: 2-[[5-[(tert-butylamino)-oxomethyl]-2-chloro-4-pyrimidinyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloropyrimidin-4-yl]amino]acetate Traditional Name: 2-[[5-(tert-butylcarbamoyl)-2-chloro-pyrimidin-4-yl]amino]acetic acid ethyl ester Formula: C13H19ClN4O3 MolecularWeight: 314.76796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=NC(=NC=C1C(=O)NC(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)CNC1=NC(=NC=C1C(=O)NC(C)(C)C)Cl

InChI

InChI=1S/C13H19ClN4O3/c1-5-21-9(19)7-15-10-8(6-16-12(14)17-10)11(20)18-13(2,3)4/h6H,5,7H2,1-4H3,(H,18,20)(H,15,16,17)