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2-[(4-bromophenyl)methylsulfanyl-[[3-(trifluoromethyl)phenyl]amino]methylidene]propanedinitrile

2-[(4-bromophenyl)methylsulfanyl-[[3-(trifluoromethyl)phenyl]amino]methylidene]propanedinitrile

Systemtic Name:2-[(4-bromophenyl)methylsulfanyl-[[3-(trifluoromethyl)phenyl]amino]methylidene]propanedinitrile
Openeye Name:2-[(4-bromophenyl)methylsulfanyl-[3-(trifluoromethyl)anilino]methylene]propanedinitrile
CAS Name:2-[[(4-bromophenyl)methylthio]-[3-(trifluoromethyl)anilino]methylidene]propanedinitrile
IUPAC Name:2-[(4-bromophenyl)methylsulfanyl-[3-(trifluoromethyl)anilino]methylidene]propanedinitrile
Traditional Name:2-[[(4-bromobenzyl)thio]-[3-(trifluoromethyl)anilino]methylene]malononitrile
Formula: C18H11BrF3N3S
MolecularWeight: 438.26425
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=C(C#N)C#N)SCC2=CC=C(C=C2)Br)C(F)(F)F


Isomeric SMILES

C1=CC(=CC(=C1)NC(=C(C#N)C#N)SCC2=CC=C(C=C2)Br)C(F)(F)F


InChI

InChI=1S/C18H11BrF3N3S/c19-15-6-4-12(5-7-15)11-26-17(13(9-23)10-24)25-16-3-1-2-14(8-16)18(20,21)22/h1-8,25H,11H2


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