9-[6-azanyl-2-(ethylamino)pyrimidin-4-yl]-2-(2-methylpyrimidin-5-yl)nonanoic acid

Systemtic Name: 9-[6-azanyl-2-(ethylamino)pyrimidin-4-yl]-2-(2-methylpyrimidin-5-yl)nonanoic acid Openeye Name: 9-[6-amino-2-(ethylamino)pyrimidin-4-yl]-2-(2-methylpyrimidin-5-yl)nonanoic acid CAS Name: 9-[6-amino-2-(ethylamino)-4-pyrimidinyl]-2-(2-methyl-5-pyrimidinyl)nonanoic acid IUPAC Name: 9-[6-amino-2-(ethylamino)pyrimidin-4-yl]-2-(2-methylpyrimidin-5-yl)nonanoic acid Traditional Name: 9-[6-amino-2-(ethylamino)pyrimidin-4-yl]-2-(2-methylpyrimidin-5-yl)pelargonic acid Formula: C20H30N6O2 MolecularWeight: 386.4912

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=CC(=N1)N)CCCCCCCC(C2=CN=C(N=C2)C)C(=O)O

Isomeric SMILES

CCNC1=NC(=CC(=N1)N)CCCCCCCC(C2=CN=C(N=C2)C)C(=O)O

InChI

InChI=1S/C20H30N6O2/c1-3-22-20-25-16(11-18(21)26-20)9-7-5-4-6-8-10-17(19(27)28)15-12-23-14(2)24-13-15/h11-13,17H,3-10H2,1-2H3,(H,27,28)(H3,21,22,25,26)