ethyl 1-[2-azanyl-5-(4-chloranylphenoxy)pyrimidin-4-yl]piperazine-2-carboxylate

Systemtic Name: ethyl 1-[2-azanyl-5-(4-chloranylphenoxy)pyrimidin-4-yl]piperazine-2-carboxylate Openeye Name: ethyl 1-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazine-2-carboxylate CAS Name: 1-[2-amino-5-(4-chlorophenoxy)-4-pyrimidinyl]-2-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazine-2-carboxylate Traditional Name: 1-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazine-2-carboxylic acid ethyl ester Formula: C17H20ClN5O3 MolecularWeight: 377.8254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CNCCN1C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CCOC(=O)C1CNCCN1C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C17H20ClN5O3/c1-2-25-16(24)13-9-20-7-8-23(13)15-14(10-21-17(19)22-15)26-12-5-3-11(18)4-6-12/h3-6,10,13,20H,2,7-9H2,1H3,(H2,19,21,22)