1-(4-bromanyl-2,5-dimethoxy-phenyl)sulfonyl-3-methyl-pyrazole

Systemtic Name: 1-(4-bromanyl-2,5-dimethoxy-phenyl)sulfonyl-3-methyl-pyrazole Openeye Name: 1-(4-bromo-2,5-dimethoxy-phenyl)sulfonyl-3-methyl-pyrazole CAS Name: 1-(4-bromo-2,5-dimethoxyphenyl)sulfonyl-3-methylpyrazole IUPAC Name: 1-(4-bromo-2,5-dimethoxyphenyl)sulfonyl-3-methylpyrazole Traditional Name: 1-(4-bromo-2,5-dimethoxy-phenyl)sulfonyl-3-methyl-pyrazole Formula: C12H13BrN2O4S MolecularWeight: 361.21162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)S(=O)(=O)C2=C(C=C(C(=C2)OC)Br)OC

Isomeric SMILES

CC1=NN(C=C1)S(=O)(=O)C2=C(C=C(C(=C2)OC)Br)OC

InChI

InChI=1S/C12H13BrN2O4S/c1-8-4-5-15(14-8)20(16,17)12-7-10(18-2)9(13)6-11(12)19-3/h4-7H,1-3H3