3-(5-bromanylthiophen-2-yl)-2-(2-chloranyl-6-fluoranyl-phenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-2-(2-chloranyl-6-fluoranyl-phenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(5-bromo-2-thienyl)-2-(2-chloro-6-fluoro-phenyl)-3-oxo-propanenitrile CAS Name: 3-(5-bromo-2-thiophenyl)-2-(2-chloro-6-fluorophenyl)-3-oxopropanenitrile IUPAC Name: 3-(5-bromothiophen-2-yl)-2-(2-chloro-6-fluorophenyl)-3-oxopropanenitrile Traditional Name: 3-(5-bromo-2-thienyl)-2-(2-chloro-6-fluoro-phenyl)-3-keto-propionitrile Formula: C13H6BrClFNOS MolecularWeight: 358.613243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C(C#N)C(=O)C2=CC=C(S2)Br)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C(C#N)C(=O)C2=CC=C(S2)Br)F

InChI

InChI=1S/C13H6BrClFNOS/c14-11-5-4-10(19-11)13(18)7(6-17)12-8(15)2-1-3-9(12)16/h1-5,7H