4-(4-fluorophenyl)-5-[2-[4-[(2-fluorophenyl)methylidene]piperidin-1-yl]ethyl]-2-methylsulfanyl-pyrimidine dihydrochloride

Systemtic Name: 4-(4-fluorophenyl)-5-[2-[4-[(2-fluorophenyl)methylidene]piperidin-1-yl]ethyl]-2-methylsulfanyl-pyrimidine dihydrochloride Openeye Name: 4-(4-fluorophenyl)-5-[2-[4-[(2-fluorophenyl)methylene]-1-piperidyl]ethyl]-2-methylsulfanyl-pyrimidine dihydrochloride CAS Name: 4-(4-fluorophenyl)-5-[2-[4-[(2-fluorophenyl)methylidene]-1-piperidinyl]ethyl]-2-(methylthio)pyrimidine dihydrochloride IUPAC Name: 4-(4-fluorophenyl)-5-[2-[4-[(2-fluorophenyl)methylidene]piperidin-1-yl]ethyl]-2-methylsulfanylpyrimidine dihydrochloride Traditional Name: 5-[2-[4-(2-fluorobenzylidene)piperidino]ethyl]-4-(4-fluorophenyl)-2-(methylthio)pyrimidine dihydrochloride Formula: C25H27Cl2F2N3S MolecularWeight: 510.469786

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C2=CC=C(C=C2)F)CCN3CCC(=CC4=CC=CC=C4F)CC3.Cl.Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C2=CC=C(C=C2)F)CCN3CCC(=CC4=CC=CC=C4F)CC3.Cl.Cl

InChI

InChI=1S/C25H25F2N3S.2ClH/c1-31-25-28-17-21(24(29-25)19-6-8-22(26)9-7-19)12-15-30-13-10-18(11-14-30)16-20-4-2-3-5-23(20)27;;/h2-9,16-17H,10-15H2,1H3;2*1H