ethyl 1-[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-amino-6-(N-ethylanilino)-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2N)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2N)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C20H27N5O2/c1-3-25(16-8-6-5-7-9-16)19-17(21)18(22-14-23-19)24-12-10-15(11-13-24)20(26)27-4-2/h5-9,14-15H,3-4,10-13,21H2,1-2H3