2-[[2-[carboxycarbonyl(propyl)amino]-6-morpholin-4-yl-5-propyl-pyrimidin-4-yl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-[carboxycarbonyl(propyl)amino]-6-morpholin-4-yl-5-propyl-pyrimidin-4-yl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[6-morpholino-2-[oxalo(propyl)amino]-5-propyl-pyrimidin-4-yl]amino]-2-oxo-acetic acid CAS Name: 2-[[6-(4-morpholinyl)-2-[oxalo(propyl)amino]-5-propyl-4-pyrimidinyl]amino]-2-oxoacetic acid IUPAC Name: 2-[[6-morpholin-4-yl-2-[oxalo(propyl)amino]-5-propylpyrimidin-4-yl]amino]-2-oxoacetic acid Traditional Name: 2-keto-2-[[6-morpholino-2-[oxalo(propyl)amino]-5-propyl-pyrimidin-4-yl]amino]acetic acid Formula: C18H25N5O7 MolecularWeight: 423.4204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(N=C1NC(=O)C(=O)O)N(CCC)C(=O)C(=O)O)N2CCOCC2

Isomeric SMILES

CCCC1=C(N=C(N=C1NC(=O)C(=O)O)N(CCC)C(=O)C(=O)O)N2CCOCC2

InChI

InChI=1S/C18H25N5O7/c1-3-5-11-12(19-14(24)16(26)27)20-18(23(6-4-2)15(25)17(28)29)21-13(11)22-7-9-30-10-8-22/h3-10H2,1-2H3,(H,26,27)(H,28,29)(H,19,20,21,24)