4-cyano-2-fluoranyl-N-[[4-(propanoylcarbamothioylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-cyano-2-fluoranyl-N-[[4-(propanoylcarbamothioylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-cyano-2-fluoro-N-[[4-(propanoylcarbamothioylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-cyano-2-fluoro-N-[[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-cyano-2-fluoro-N-[[4-(propanoylcarbamothioylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-cyano-2-fluoro-N-[[4-(propionylthiocarbamoylamino)phenyl]thiocarbamoyl]benzamide Formula: C19H16FN5O2S2 MolecularWeight: 429.491043

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C19H16FN5O2S2/c1-2-16(26)24-18(28)22-12-4-6-13(7-5-12)23-19(29)25-17(27)14-8-3-11(10-21)9-15(14)20/h3-9H,2H2,1H3,(H2,22,24,26,28)(H2,23,25,27,29)