4-butan-2-yl-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-butan-2-yl-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-sec-butyl-benzenesulfonamide CAS Name: 4-butan-2-yl-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]benzenesulfonamide IUPAC Name: 4-butan-2-yl-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]benzenesulfonamide Traditional Name: N-[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-4-sec-butyl-benzenesulfonamide Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC=CC=C3Cl)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C22H26ClN3O2S/c1-5-15(2)18-10-12-20(13-11-18)29(27,28)25-22-16(3)24-26(17(22)4)14-19-8-6-7-9-21(19)23/h6-13,15,25H,5,14H2,1-4H3