9-[2-azanyl-6-(ethylamino)pyrimidin-4-yl]-3-(6-ethylpyridin-3-yl)nonanoic acid

Systemtic Name: 9-[2-azanyl-6-(ethylamino)pyrimidin-4-yl]-3-(6-ethylpyridin-3-yl)nonanoic acid Openeye Name: 9-[2-amino-6-(ethylamino)pyrimidin-4-yl]-3-(6-ethyl-3-pyridyl)nonanoic acid CAS Name: 9-[2-amino-6-(ethylamino)-4-pyrimidinyl]-3-(6-ethyl-3-pyridinyl)nonanoic acid IUPAC Name: 9-[2-amino-6-(ethylamino)pyrimidin-4-yl]-3-(6-ethylpyridin-3-yl)nonanoic acid Traditional Name: 9-[2-amino-6-(ethylamino)pyrimidin-4-yl]-3-(6-ethyl-3-pyridyl)pelargonic acid Formula: C22H33N5O2 MolecularWeight: 399.52972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C=C1)C(CCCCCCC2=CC(=NC(=N2)N)NCC)CC(=O)O

Isomeric SMILES

CCC1=NC=C(C=C1)C(CCCCCCC2=CC(=NC(=N2)N)NCC)CC(=O)O

InChI

InChI=1S/C22H33N5O2/c1-3-18-12-11-17(15-25-18)16(13-21(28)29)9-7-5-6-8-10-19-14-20(24-4-2)27-22(23)26-19/h11-12,14-16H,3-10,13H2,1-2H3,(H,28,29)(H3,23,24,26,27)