S-phenyl 5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carbothioate

Systemtic Name: S-phenyl 5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carbothioate Openeye Name: S-phenyl 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carbothioate CAS Name: 5-chloro-2-[(4-fluorophenyl)methylthio]-4-pyrimidinecarbothioic acid S-phenyl ester IUPAC Name: S-phenyl 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carbothioate Traditional Name: 5-chloro-2-[(4-fluorobenzyl)thio]pyrimidine-4-carbothioic acid S-phenyl ester Formula: C18H12ClFN2OS2 MolecularWeight: 390.882083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClFN2OS2/c19-15-10-21-18(24-11-12-6-8-13(20)9-7-12)22-16(15)17(23)25-14-4-2-1-3-5-14/h1-10H,11H2