1-[4-[2-azanyl-5-(4-chloranylphenoxy)pyrimidin-4-yl]piperazin-1-yl]-2-methoxy-ethanone

Systemtic Name: 1-[4-[2-azanyl-5-(4-chloranylphenoxy)pyrimidin-4-yl]piperazin-1-yl]-2-methoxy-ethanone Openeye Name: 1-[4-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazin-1-yl]-2-methoxy-ethanone CAS Name: 1-[4-[2-amino-5-(4-chlorophenoxy)-4-pyrimidinyl]-1-piperazinyl]-2-methoxyethanone IUPAC Name: 1-[4-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazin-1-yl]-2-methoxyethanone Traditional Name: 1-[4-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazino]-2-methoxy-ethanone Formula: C17H20ClN5O3 MolecularWeight: 377.8254

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCN(CC1)C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)N

Isomeric SMILES

COCC(=O)N1CCN(CC1)C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C17H20ClN5O3/c1-25-11-15(24)22-6-8-23(9-7-22)16-14(10-20-17(19)21-16)26-13-4-2-12(18)3-5-13/h2-5,10H,6-9,11H2,1H3,(H2,19,20,21)