[4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone CAS Name: [4-(3,5-dimethyl-1-pyrazolyl)phenyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Traditional Name: (4-benzylsulfonylpiperazino)-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H26N4O3S/c1-18-16-19(2)27(24-18)22-10-8-21(9-11-22)23(28)25-12-14-26(15-13-25)31(29,30)17-20-6-4-3-5-7-20/h3-11,16H,12-15,17H2,1-2H3