4-[2,4-bis(chloranyl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 4-(2,4-dichlorophenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(2,4-dichlorophenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C18H20Cl2N4O2 MolecularWeight: 395.283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H20Cl2N4O2/c19-14-4-5-16(15(20)13-14)26-12-1-3-17(25)23-8-10-24(11-9-23)18-21-6-2-7-22-18/h2,4-7,13H,1,3,8-12H2