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

Systemtic Name: ethyl 1-[5-azanyl-6-[(2-ethylphenyl)amino]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-amino-6-(2-ethylanilino)pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-amino-6-(2-ethylanilino)-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-amino-6-(2-ethylanilino)pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-amino-6-(2-ethylanilino)pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC=NC(=C2N)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC=NC(=C2N)N3CCC(CC3)C(=O)OCC

InChI

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