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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(C1)C2=C(C=CC(=C2OC)Br)SC

Isomeric SMILES

CC1=NOC(C1)C2=C(C=CC(=C2OC)Br)SC

InChI

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