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

Systemtic Name: 5-bromanyl-2-[(4-chlorophenyl)methylsulfanyl]-N-(2-fluorophenyl)pyrimidine-4-carboxamide Openeye Name: 5-bromo-2-[(4-chlorophenyl)methylsulfanyl]-N-(2-fluorophenyl)pyrimidine-4-carboxamide CAS Name: 5-bromo-2-[(4-chlorophenyl)methylthio]-N-(2-fluorophenyl)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-2-[(4-chlorophenyl)methylsulfanyl]-N-(2-fluorophenyl)pyrimidine-4-carboxamide Traditional Name: 5-bromo-2-[(4-chlorobenzyl)thio]-N-(2-fluorophenyl)pyrimidine-4-carboxamide Formula: C18H12BrClFN3OS MolecularWeight: 452.727783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12BrClFN3OS/c19-13-9-22-18(26-10-11-5-7-12(20)8-6-11)24-16(13)17(25)23-15-4-2-1-3-14(15)21/h1-9H,10H2,(H,23,25)