5-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-methoxy-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-methoxy-benzenesulfonamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-bromo-2-methoxy-benzenesulfonamide CAS Name: 5-bromo-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-methoxybenzenesulfonamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-5-bromo-2-methoxybenzenesulfonamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-bromo-2-methoxy-benzenesulfonamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C20H22BrN3O3S/c1-14-18(15(2)24(23-14)13-16-7-5-4-6-8-16)12-22-28(25,26)20-11-17(21)9-10-19(20)27-3/h4-11,22H,12-13H2,1-3H3