ethyl 1-[5-azanyl-6-(oxolan-2-ylmethylamino)pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-azanyl-6-(oxolan-2-ylmethylamino)pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-amino-6-(tetrahydrofuran-2-ylmethylamino)pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-amino-6-(2-oxolanylmethylamino)-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-amino-6-(oxolan-2-ylmethylamino)pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-amino-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C17H27N5O3 MolecularWeight: 349.42798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NCC3CCCO3)N

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NCC3CCCO3)N

InChI

InChI=1S/C17H27N5O3/c1-2-24-17(23)12-5-7-22(8-6-12)16-14(18)15(20-11-21-16)19-10-13-4-3-9-25-13/h11-13H,2-10,18H2,1H3,(H,19,20,21)