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

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[(2-chloro-6-fluorophenyl)methylthio]-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)thio]-6-pyrrolidino-pyrimidine Formula: C15H15ClFN3S MolecularWeight: 323.816103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C15H15ClFN3S/c16-12-4-3-5-13(17)11(12)9-21-15-8-14(18-10-19-15)20-6-1-2-7-20/h3-5,8,10H,1-2,6-7,9H2