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

Systemtic Name: 5-chloranyl-N-(2-chlorophenyl)-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(2-chlorophenyl)-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(2-chlorophenyl)-2-[(4-fluorophenyl)methylthio]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(2-chlorophenyl)-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(2-chlorophenyl)-2-[(4-fluorobenzyl)thio]pyrimidine-4-carboxamide Formula: C18H12Cl2FN3OS MolecularWeight: 408.276783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C18H12Cl2FN3OS/c19-13-3-1-2-4-15(13)23-17(25)16-14(20)9-22-18(24-16)26-10-11-5-7-12(21)8-6-11/h1-9H,10H2,(H,23,25)