2-[[2-[carboxycarbonyl(ethyl)amino]-5-ethyl-6-pyrrolidin-1-yl-pyrimidin-4-yl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-[carboxycarbonyl(ethyl)amino]-5-ethyl-6-pyrrolidin-1-yl-pyrimidin-4-yl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-pyrrolidin-1-yl-pyrimidin-4-yl]amino]-2-oxo-acetic acid CAS Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]-2-oxoacetic acid IUPAC Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-pyrrolidin-1-ylpyrimidin-4-yl]amino]-2-oxoacetic acid Traditional Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-pyrrolidino-pyrimidin-4-yl]amino]-2-keto-acetic acid Formula: C16H21N5O6 MolecularWeight: 379.36784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1NC(=O)C(=O)O)N(CC)C(=O)C(=O)O)N2CCCC2

Isomeric SMILES

CCC1=C(N=C(N=C1NC(=O)C(=O)O)N(CC)C(=O)C(=O)O)N2CCCC2

InChI

InChI=1S/C16H21N5O6/c1-3-9-10(17-12(22)14(24)25)18-16(21(4-2)13(23)15(26)27)19-11(9)20-7-5-6-8-20/h3-8H2,1-2H3,(H,24,25)(H,26,27)(H,17,18,19,22)