5-[(3-bromanyl-4-methoxy-phenyl)methylsulfinylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[(3-bromanyl-4-methoxy-phenyl)methylsulfinylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[(3-bromo-4-methoxy-phenyl)methylsulfinylmethyl]-3-methyl-isoxazole CAS Name: 5-[(3-bromo-4-methoxyphenyl)methylsulfinylmethyl]-3-methylisoxazole IUPAC Name: 5-[(3-bromo-4-methoxyphenyl)methylsulfinylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[(3-bromo-4-methoxy-benzyl)sulfinylmethyl]-3-methyl-isoxazole Formula: C13H14BrNO3S MolecularWeight: 344.22416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CS(=O)CC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC1=NOC(=C1)CS(=O)CC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C13H14BrNO3S/c1-9-5-11(18-15-9)8-19(16)7-10-3-4-13(17-2)12(14)6-10/h3-6H,7-8H2,1-2H3