N-(4-chloranyl-2-fluoranyl-phenyl)-2-[4-(3,5-dimethylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-[4-(3,5-dimethylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(3,5-dimethylphenyl)-3-oxo-pyrazin-2-yl]sulfanyl-acetamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[[4-(3,5-dimethylphenyl)-3-oxo-2-pyrazinyl]thio]acetamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[[4-(3,5-dimethylphenyl)-3-keto-pyrazin-2-yl]thio]acetamide Formula: C20H17ClFN3O2S MolecularWeight: 417.884283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC(=O)NC3=C(C=C(C=C3)Cl)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC(=O)NC3=C(C=C(C=C3)Cl)F)C

InChI

InChI=1S/C20H17ClFN3O2S/c1-12-7-13(2)9-15(8-12)25-6-5-23-19(20(25)27)28-11-18(26)24-17-4-3-14(21)10-16(17)22/h3-10H,11H2,1-2H3,(H,24,26)