2-[4-[bis(fluoranyl)methoxy]phenyl]-3-(5-bromanylthiophen-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-[4-[bis(fluoranyl)methoxy]phenyl]-3-(5-bromanylthiophen-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(5-bromo-2-thienyl)-2-[4-(difluoromethoxy)phenyl]-3-oxo-propanenitrile CAS Name: 3-(5-bromo-2-thiophenyl)-2-[4-(difluoromethoxy)phenyl]-3-oxopropanenitrile IUPAC Name: 3-(5-bromothiophen-2-yl)-2-[4-(difluoromethoxy)phenyl]-3-oxopropanenitrile Traditional Name: 3-(5-bromo-2-thienyl)-2-[4-(difluoromethoxy)phenyl]-3-keto-propionitrile Formula: C14H8BrF2NO2S MolecularWeight: 372.184626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C#N)C(=O)C2=CC=C(S2)Br)OC(F)F

Isomeric SMILES

C1=CC(=CC=C1C(C#N)C(=O)C2=CC=C(S2)Br)OC(F)F

InChI

InChI=1S/C14H8BrF2NO2S/c15-12-6-5-11(21-12)13(19)10(7-18)8-1-3-9(4-2-8)20-14(16)17/h1-6,10,14H