1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyl-4-pyrazolyl)methyl]piperazine IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CN(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CN(N=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H26N4O2S/c1-18-8-9-22(19(2)14-18)29(27,28)25-12-10-24(11-13-25)16-20-15-23-26(17-20)21-6-4-3-5-7-21/h3-9,14-15,17H,10-13,16H2,1-2H3