4-bromanyl-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)benzenesulfonamide Openeye Name: 4-bromo-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-benzenesulfonamide CAS Name: 4-bromo-N-[[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-4-pyrazolyl]methyl]-N-(2-methylpropyl)benzenesulfonamide IUPAC Name: 4-bromo-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methyl]-N-(2-methylpropyl)benzenesulfonamide Traditional Name: 4-bromo-N-[[5-(4-ethylpiperazino)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-benzenesulfonamide Formula: C27H36BrN5O2S MolecularWeight: 574.57604

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H36BrN5O2S/c1-5-30-15-17-31(18-16-30)27-26(22(4)29-33(27)24-9-7-6-8-10-24)20-32(19-21(2)3)36(34,35)25-13-11-23(28)12-14-25/h6-14,21H,5,15-20H2,1-4H3