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

Systemtic Name: 2-[[2-[carboxycarbonyl(ethyl)amino]-5-ethyl-6-piperidin-1-yl-pyrimidin-4-yl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-(1-piperidyl)pyrimidin-4-yl]amino]-2-oxo-acetic acid CAS Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-(1-piperidinyl)-4-pyrimidinyl]amino]-2-oxoacetic acid IUPAC Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-piperidin-1-ylpyrimidin-4-yl]amino]-2-oxoacetic acid Traditional Name: 2-[[5-ethyl-2-[ethyl(oxalo)amino]-6-piperidino-pyrimidin-4-yl]amino]-2-keto-acetic acid Formula: C17H23N5O6 MolecularWeight: 393.39442

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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)N2CCCCC2

Isomeric SMILES

CCC1=C(N=C(N=C1NC(=O)C(=O)O)N(CC)C(=O)C(=O)O)N2CCCCC2

InChI

InChI=1S/C17H23N5O6/c1-3-10-11(18-13(23)15(25)26)19-17(22(4-2)14(24)16(27)28)20-12(10)21-8-6-5-7-9-21/h3-9H2,1-2H3,(H,25,26)(H,27,28)(H,18,19,20,23)