ethyl 4-[5-azanyl-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-azanyl-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[5-amino-6-(3,5-dimethylphenoxy)-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)OC3=CC(=CC(=C3)C)C)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)OC3=CC(=CC(=C3)C)C)N

InChI

InChI=1S/C19H25N5O3/c1-4-26-19(25)24-7-5-23(6-8-24)17-16(20)18(22-12-21-17)27-15-10-13(2)9-14(3)11-15/h9-12H,4-8,20H2,1-3H3