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

Systemtic Name: 2-[4-(3,5-dimethylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-(3,5-dimethylphenyl)-3-oxo-pyrazin-2-yl]sulfanyl-N-(4-fluorophenyl)acetamide CAS Name: 2-[[4-(3,5-dimethylphenyl)-3-oxo-2-pyrazinyl]thio]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[4-(3,5-dimethylphenyl)-3-keto-pyrazin-2-yl]thio]-N-(4-fluorophenyl)acetamide Formula: C20H18FN3O2S MolecularWeight: 383.439223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18FN3O2S/c1-13-9-14(2)11-17(10-13)24-8-7-22-19(20(24)26)27-12-18(25)23-16-5-3-15(21)4-6-16/h3-11H,12H2,1-2H3,(H,23,25)