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

Systemtic Name: N-[2-chloranyl-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[2-chloro-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[2-chloro-4-[[[[1-(4-cyanophenyl)ethylthio]amino]-oxomethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[2-chloro-4-[1-(4-cyanophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[2-chloro-4-[[1-(4-cyanophenyl)ethylthio]carbamoylamino]phenyl]-2-fluoro-benzamide Formula: C23H18ClFN4O2S MolecularWeight: 468.931023

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H18ClFN4O2S/c1-14(16-8-6-15(13-26)7-9-16)32-29-23(31)27-17-10-11-21(19(24)12-17)28-22(30)18-4-2-3-5-20(18)25/h2-12,14H,1H3,(H,28,30)(H2,27,29,31)