5-[4-[2-(4-bromanylphenoxy)ethoxy]phenyl]-3-methylsulfanyl-1,2-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[2-(4-bromanylphenoxy)ethoxy]phenyl]-3-methylsulfanyl-1,2-oxazole-4-carbonitrile Openeye Name: 5-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-methylsulfanyl-isoxazole-4-carbonitrile CAS Name: 5-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-(methylthio)-4-isoxazolecarbonitrile IUPAC Name: 5-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-methylsulfanyl-1,2-oxazole-4-carbonitrile Traditional Name: 5-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-(methylthio)isoxazole-4-carbonitrile Formula: C19H15BrN2O3S MolecularWeight: 431.303

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NOC(=C1C#N)C2=CC=C(C=C2)OCCOC3=CC=C(C=C3)Br

Isomeric SMILES

CSC1=NOC(=C1C#N)C2=CC=C(C=C2)OCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H15BrN2O3S/c1-26-19-17(12-21)18(25-22-19)13-2-6-15(7-3-13)23-10-11-24-16-8-4-14(20)5-9-16/h2-9H,10-11H2,1H3