[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: [1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[1-(3-chlorophenyl)-5-ethyl-4-pyrazolyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[1-(3-chlorophenyl)-5-ethylpyrazol-4-yl]methanone Traditional Name: (4-besylpiperazino)-[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]methanone Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O3S/c1-2-21-20(16-24-27(21)18-8-6-7-17(23)15-18)22(28)25-11-13-26(14-12-25)31(29,30)19-9-4-3-5-10-19/h3-10,15-16H,2,11-14H2,1H3