3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-1-(4-methylphenyl)pyrazin-2-one

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-1-(4-methylphenyl)pyrazin-2-one Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-1-(p-tolyl)pyrazin-2-one CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-1-(4-methylphenyl)-2-pyrazinone IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-1-(4-methylphenyl)pyrazin-2-one Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-1-(p-tolyl)pyrazin-2-one Formula: C18H14ClFN2OS MolecularWeight: 360.832963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=CN=C(C2=O)SCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C=CN=C(C2=O)SCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C18H14ClFN2OS/c1-12-2-6-15(7-3-12)22-9-8-21-17(18(22)23)24-11-13-4-5-14(20)10-16(13)19/h2-10H,11H2,1H3