5-chloranyl-N-[4-(4-fluoranylphenoxy)butyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-(4-fluoranylphenoxy)butyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[4-(4-fluorophenoxy)butyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-(4-fluorophenoxy)butyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-(4-fluorophenoxy)butyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-(4-fluorophenoxy)butyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H17ClFN3O2S MolecularWeight: 369.841483

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCCCCOC2=CC=C(C=C2)F)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCCCCOC2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C16H17ClFN3O2S/c1-24-16-20-10-13(17)14(21-16)15(22)19-8-2-3-9-23-12-6-4-11(18)5-7-12/h4-7,10H,2-3,8-9H2,1H3,(H,19,22)