N-[2-cyano-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-cyano-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[2-cyano-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[2-cyano-4-[[[[1-(4-cyanophenyl)ethylthio]amino]-oxomethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[2-cyano-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[2-cyano-4-[[1-(4-cyanophenyl)ethylthio]carbamoylamino]phenyl]-2-fluoro-benzamide Formula: C24H18FN5O2S MolecularWeight: 459.495423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)SNC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3F)C#N

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)SNC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3F)C#N

InChI

InChI=1S/C24H18FN5O2S/c1-15(17-8-6-16(13-26)7-9-17)33-30-24(32)28-19-10-11-22(18(12-19)14-27)29-23(31)20-4-2-3-5-21(20)25/h2-12,15H,1H3,(H,29,31)(H2,28,30,32)