3-(3-bromanyl-2-ethoxy-6-methylsulfanyl-phenyl)-4,5-dihydro-1,2-oxazole

Systemtic Name: 3-(3-bromanyl-2-ethoxy-6-methylsulfanyl-phenyl)-4,5-dihydro-1,2-oxazole Openeye Name: 3-(3-bromo-2-ethoxy-6-methylsulfanyl-phenyl)-4,5-dihydroisoxazole CAS Name: 3-[3-bromo-2-ethoxy-6-(methylthio)phenyl]-4,5-dihydroisoxazole IUPAC Name: 3-(3-bromo-2-ethoxy-6-methylsulfanylphenyl)-4,5-dihydro-1,2-oxazole Traditional Name: 3-[3-bromo-2-ethoxy-6-(methylthio)phenyl]-2-isoxazoline Formula: C12H14BrNO2S MolecularWeight: 316.21406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1C2=NOCC2)SC)Br

Isomeric SMILES

CCOC1=C(C=CC(=C1C2=NOCC2)SC)Br

InChI

InChI=1S/C12H14BrNO2S/c1-3-15-12-8(13)4-5-10(17-2)11(12)9-6-7-16-14-9/h4-5H,3,6-7H2,1-2H3