4-[3-[3-methoxypropyl(methyl)amino]-2-methyl-4-methylsulfonyl-phenyl]carbonyl-2-methyl-1H-pyrazol-3-one

Systemtic Name: 4-[3-[3-methoxypropyl(methyl)amino]-2-methyl-4-methylsulfonyl-phenyl]carbonyl-2-methyl-1H-pyrazol-3-one Openeye Name: 4-[3-[3-methoxypropyl(methyl)amino]-2-methyl-4-methylsulfonyl-benzoyl]-2-methyl-1H-pyrazol-3-one CAS Name: 4-[[3-[3-methoxypropyl(methyl)amino]-2-methyl-4-methylsulfonylphenyl]-oxomethyl]-2-methyl-1H-pyrazol-3-one IUPAC Name: 4-[3-[3-methoxypropyl(methyl)amino]-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one Traditional Name: 4-[4-mesyl-3-[3-methoxypropyl(methyl)amino]-2-methyl-benzoyl]-2-methyl-3-pyrazolin-3-one Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1N(C)CCCOC)S(=O)(=O)C)C(=O)C2=CNN(C2=O)C

Isomeric SMILES

CC1=C(C=CC(=C1N(C)CCCOC)S(=O)(=O)C)C(=O)C2=CNN(C2=O)C

InChI

InChI=1S/C18H25N3O5S/c1-12-13(17(22)14-11-19-21(3)18(14)23)7-8-15(27(5,24)25)16(12)20(2)9-6-10-26-4/h7-8,11,19H,6,9-10H2,1-5H3