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

Systemtic Name: 2-[4-(3,5-dimethylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-(3-fluoranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[4-(3,5-dimethylphenyl)-3-oxo-pyrazin-2-yl]sulfanyl-N-(3-fluoro-4-methyl-phenyl)acetamide CAS Name: 2-[[4-(3,5-dimethylphenyl)-3-oxo-2-pyrazinyl]thio]-N-(3-fluoro-4-methylphenyl)acetamide IUPAC Name: 2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-(3-fluoro-4-methylphenyl)acetamide Traditional Name: 2-[[4-(3,5-dimethylphenyl)-3-keto-pyrazin-2-yl]thio]-N-(3-fluoro-4-methyl-phenyl)acetamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=CN(C2=O)C3=CC(=CC(=C3)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=CN(C2=O)C3=CC(=CC(=C3)C)C)F

InChI

InChI=1S/C21H20FN3O2S/c1-13-8-14(2)10-17(9-13)25-7-6-23-20(21(25)27)28-12-19(26)24-16-5-4-15(3)18(22)11-16/h4-11H,12H2,1-3H3,(H,24,26)