4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6-(1-piperidyl)pyrimidine CAS Name: 4-[(2-chloro-6-fluorophenyl)methylthio]-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-piperidin-1-ylpyrimidine Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)thio]-6-piperidino-pyrimidine Formula: C16H17ClFN3S MolecularWeight: 337.842683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H17ClFN3S/c17-13-5-4-6-14(18)12(13)10-22-16-9-15(19-11-20-16)21-7-2-1-3-8-21/h4-6,9,11H,1-3,7-8,10H2