N-(4-fluorophenyl)-2-[2-(1H-perimidin-2-ylsulfanyl)ethanoylamino]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[2-(1H-perimidin-2-ylsulfanyl)ethanoylamino]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[[2-(1H-perimidin-2-ylsulfanyl)acetyl]amino]acetamide CAS Name: N-(4-fluorophenyl)-2-[[1-oxo-2-(1H-perimidin-2-ylthio)ethyl]amino]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[[2-(1H-perimidin-2-ylsulfanyl)acetyl]amino]acetamide Traditional Name: N-(4-fluorophenyl)-2-[[2-(1H-perimidin-2-ylthio)acetyl]amino]acetamide Formula: C21H17FN4O2S MolecularWeight: 408.448683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4O2S/c22-14-7-9-15(10-8-14)24-18(27)11-23-19(28)12-29-21-25-16-5-1-3-13-4-2-6-17(26-21)20(13)16/h1-10H,11-12H2,(H,23,28)(H,24,27)(H,25,26)