4-[1-[(5-bromanyl-2-methoxy-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine

Systemtic Name: 4-[1-[(5-bromanyl-2-methoxy-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine Openeye Name: 4-[1-[(5-bromo-2-methoxy-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine CAS Name: 4-[[1-[(5-bromo-2-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-[(5-bromo-2-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]sulfonylmorpholine Traditional Name: 4-[1-(5-bromo-2-methoxy-benzyl)-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine Formula: C17H22BrN3O4S MolecularWeight: 444.34328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)Br)OC)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)Br)OC)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H22BrN3O4S/c1-12-17(26(22,23)20-6-8-25-9-7-20)13(2)21(19-12)11-14-10-15(18)4-5-16(14)24-3/h4-5,10H,6-9,11H2,1-3H3