[1-(3-chlorophenyl)-5-methyl-pyrazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [1-(3-chlorophenyl)-5-methyl-pyrazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [1-(3-chlorophenyl)-5-methyl-pyrazol-4-yl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [1-(3-chlorophenyl)-5-methyl-4-pyrazolyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [1-(3-chlorophenyl)-5-methylpyrazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [1-(3-chlorophenyl)-5-methyl-pyrazol-4-yl]-(4-tosylpiperazino)methanone Formula: C22H23ClN4O3S MolecularWeight: 458.96102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC(=CC=C4)Cl)C

InChI

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