4-butyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide Openeye Name: 4-butyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide CAS Name: 4-butyl-N-[1-[(2-fluorophenyl)methyl]-4-pyrazolyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]benzenesulfonamide Traditional Name: 4-butyl-N-[1-(2-fluorobenzyl)pyrazol-4-yl]benzenesulfonamide Formula: C20H22FN3O2S MolecularWeight: 387.470983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC=C3F

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C20H22FN3O2S/c1-2-3-6-16-9-11-19(12-10-16)27(25,26)23-18-13-22-24(15-18)14-17-7-4-5-8-20(17)21/h4-5,7-13,15,23H,2-3,6,14H2,1H3