4-[4-(5-chloranylpyrimidin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[4-(5-chloranylpyrimidin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[4-(5-chloro-2-pyrimidinyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[4-(5-chloropyrimidin-2-yl)piperazino]-1-(4-fluorophenyl)butan-1-one Formula: C18H20ClFN4O MolecularWeight: 362.829003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=C(C=N3)Cl

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=C(C=N3)Cl

InChI

InChI=1S/C18H20ClFN4O/c19-15-12-21-18(22-13-15)24-10-8-23(9-11-24)7-1-2-17(25)14-3-5-16(20)6-4-14/h3-6,12-13H,1-2,7-11H2