[3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: [1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-(4-mesylpiperazino)methanone Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O3S/c1-31(29,30)27-13-11-25(12-14-27)22(28)20-16-26(15-17-5-3-2-4-6-17)24-21(20)18-7-9-19(23)10-8-18/h2-10,16H,11-15H2,1H3