5-methyl-2-(4-piperidin-1-ylsulfonylphenyl)-1H-pyrazol-3-one

Systemtic Name: 5-methyl-2-(4-piperidin-1-ylsulfonylphenyl)-1H-pyrazol-3-one Openeye Name: 5-methyl-2-[4-(1-piperidylsulfonyl)phenyl]-1H-pyrazol-3-one CAS Name: 5-methyl-2-[4-(1-piperidinylsulfonyl)phenyl]-1H-pyrazol-3-one IUPAC Name: 5-methyl-2-(4-piperidin-1-ylsulfonylphenyl)-1H-pyrazol-3-one Traditional Name: 5-methyl-2-(4-piperidinosulfonylphenyl)-3-pyrazolin-3-one Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C15H19N3O3S/c1-12-11-15(19)18(16-12)13-5-7-14(8-6-13)22(20,21)17-9-3-2-4-10-17/h5-8,11,16H,2-4,9-10H2,1H3