1-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)-2-phenoxy-ethanone

Systemtic Name: 1-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)-2-phenoxy-ethanone Openeye Name: 1-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]-2-phenoxy-ethanone CAS Name: 1-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]-2-phenoxyethanone IUPAC Name: 1-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)-2-phenoxyethanone Traditional Name: 1-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)-2-phenoxy-ethanone Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)COC2=CC=CC=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1C(=O)COC2=CC=CC=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H23N3O4S/c1-14-18(26(23,24)20-11-7-4-8-12-20)15(2)21(19-14)17(22)13-25-16-9-5-3-6-10-16/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3