ethyl 4-[6-methyl-2-[(4-methylphenyl)methylamino]pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-2-[(4-methylphenyl)methylamino]pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[6-methyl-2-(p-tolylmethylamino)pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-methyl-2-[(4-methylphenyl)methylamino]-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-2-[(4-methylphenyl)methylamino]pyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-methyl-2-[(4-methylbenzyl)amino]pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C)NCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C)NCC3=CC=C(C=C3)C

InChI

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