[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate CAS Name: 2-[methyl(2-pyrimidinyl)amino]acetic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate Traditional Name: 2-[methyl(2-pyrimidyl)amino]acetic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H17N5O4 MolecularWeight: 307.30518

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC(=O)NC(=O)NCC=C)C1=NC=CC=N1

Isomeric SMILES

CN(CC(=O)OCC(=O)NC(=O)NCC=C)C1=NC=CC=N1

InChI

InChI=1S/C13H17N5O4/c1-3-5-16-13(21)17-10(19)9-22-11(20)8-18(2)12-14-6-4-7-15-12/h3-4,6-7H,1,5,8-9H2,2H3,(H2,16,17,19,21)