1-[3,5-dimethyl-1-(phenylsulfonyl)pyrazol-4-yl]sulfonylpiperidine

Systemtic Name: 1-[3,5-dimethyl-1-(phenylsulfonyl)pyrazol-4-yl]sulfonylpiperidine Openeye Name: 1-[1-(benzenesulfonyl)-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperidine CAS Name: 1-[[1-(benzenesulfonyl)-3,5-dimethyl-4-pyrazolyl]sulfonyl]piperidine IUPAC Name: 1-[1-(benzenesulfonyl)-3,5-dimethylpyrazol-4-yl]sulfonylpiperidine Traditional Name: 1-(1-besyl-3,5-dimethyl-pyrazol-4-yl)sulfonylpiperidine Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C16H21N3O4S2/c1-13-16(25(22,23)18-11-7-4-8-12-18)14(2)19(17-13)24(20,21)15-9-5-3-6-10-15/h3,5-6,9-10H,4,7-8,11-12H2,1-2H3