[4-[4-[(2,4-dichlorophenyl)methoxy]pyrimidin-2-yl]piperazin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[4-[(2,4-dichlorophenyl)methoxy]pyrimidin-2-yl]piperazin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[4-[(2,4-dichlorophenyl)methoxy]pyrimidin-2-yl]piperazin-1-yl]-(3-pyridyl)methanone CAS Name: [4-[4-[(2,4-dichlorophenyl)methoxy]-2-pyrimidinyl]-1-piperazinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[4-[(2,4-dichlorophenyl)methoxy]pyrimidin-2-yl]piperazin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[4-(2,4-dichlorobenzyl)oxypyrimidin-2-yl]piperazino]-(3-pyridyl)methanone Formula: C21H19Cl2N5O2 MolecularWeight: 444.31386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=N2)OCC3=C(C=C(C=C3)Cl)Cl)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=N2)OCC3=C(C=C(C=C3)Cl)Cl)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H19Cl2N5O2/c22-17-4-3-16(18(23)12-17)14-30-19-5-7-25-21(26-19)28-10-8-27(9-11-28)20(29)15-2-1-6-24-13-15/h1-7,12-13H,8-11,14H2