4-(2-methyl-3H-pyrazol-1-yl)-5-(4-methylsulfonylphenyl)furan-3-one

Systemtic Name: 4-(2-methyl-3H-pyrazol-1-yl)-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 4-(2-methyl-3H-pyrazol-1-yl)-5-(4-methylsulfonylphenyl)furan-3-one CAS Name: 4-(2-methyl-3H-pyrazol-1-yl)-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 4-(2-methyl-3H-pyrazol-1-yl)-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 5-(4-mesylphenyl)-4-(2-methyl-3-pyrazolin-1-yl)furan-3-one Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=CN1C2=C(OCC2=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN1CC=CN1C2=C(OCC2=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C15H16N2O4S/c1-16-8-3-9-17(16)14-13(18)10-21-15(14)11-4-6-12(7-5-11)22(2,19)20/h3-7,9H,8,10H2,1-2H3