1-[(2-chlorophenyl)methyl]-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine

Systemtic Name: 1-[(2-chlorophenyl)methyl]-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine Openeye Name: 1-[(2-chlorophenyl)methyl]-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-[(2-chlorophenyl)methyl]-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]piperazine IUPAC Name: 1-[(2-chlorophenyl)methyl]-4-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-(2-chlorobenzyl)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine Formula: C22H25ClN4O2S MolecularWeight: 444.9775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C22H25ClN4O2S/c1-17-22(18(2)27(24-17)20-9-4-3-5-10-20)30(28,29)26-14-12-25(13-15-26)16-19-8-6-7-11-21(19)23/h3-11H,12-16H2,1-2H3