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

Systemtic Name: ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloranyl-pyrimidin-4-yl]-methyl-amino]ethanoate Openeye Name: ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloro-pyrimidin-4-yl]-methyl-amino]acetate CAS Name: 2-[[5-[(tert-butylamino)-oxomethyl]-2-chloro-4-pyrimidinyl]-methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(tert-butylcarbamoyl)-2-chloropyrimidin-4-yl]-methylamino]acetate Traditional Name: 2-[[5-(tert-butylcarbamoyl)-2-chloro-pyrimidin-4-yl]-methyl-amino]acetic acid ethyl ester Formula: C14H21ClN4O3 MolecularWeight: 328.79454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)C1=NC(=NC=C1C(=O)NC(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)CN(C)C1=NC(=NC=C1C(=O)NC(C)(C)C)Cl

InChI

InChI=1S/C14H21ClN4O3/c1-6-22-10(20)8-19(5)11-9(7-16-13(15)17-11)12(21)18-14(2,3)4/h7H,6,8H2,1-5H3,(H,18,21)