[4-[2-azanyl-5-(4-chloranylphenoxy)pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[2-azanyl-5-(4-chloranylphenoxy)pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[2-amino-5-(4-chlorophenoxy)-4-pyrimidinyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[2-amino-5-(4-chlorophenoxy)pyrimidin-4-yl]piperazino]-phenyl-methanone Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)N)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)N)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20ClN5O2/c22-16-6-8-17(9-7-16)29-18-14-24-21(23)25-19(18)26-10-12-27(13-11-26)20(28)15-4-2-1-3-5-15/h1-9,14H,10-13H2,(H2,23,24,25)