5-bromanyl-2-[(4-fluorophenyl)methylsulfanyl]-N-phenyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-2-[(4-fluorophenyl)methylsulfanyl]-N-phenyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-2-[(4-fluorophenyl)methylsulfanyl]-N-phenyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-2-[(4-fluorophenyl)methylthio]-N-phenyl-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-2-[(4-fluorophenyl)methylsulfanyl]-N-phenylpyrimidine-4-carboxamide Traditional Name: 5-bromo-2-[(4-fluorobenzyl)thio]-N-phenyl-pyrimidine-4-carboxamide Formula: C18H13BrFN3OS MolecularWeight: 418.282723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Br)SCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Br)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H13BrFN3OS/c19-15-10-21-18(25-11-12-6-8-13(20)9-7-12)23-16(15)17(24)22-14-4-2-1-3-5-14/h1-10H,11H2,(H,22,24)