1-[2-[5-(3-fluoranyl-4-methoxy-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]but-3-yn-2-yl]-1-oxidanyl-urea

Systemtic Name: 1-[2-[5-(3-fluoranyl-4-methoxy-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]but-3-yn-2-yl]-1-oxidanyl-urea Openeye Name: 1-[1-[5-(3-fluoro-4-methoxy-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-1-methyl-prop-2-ynyl]-1-hydroxy-urea CAS Name: 1-[2-[5-(3-fluoro-4-methoxyphenyl)-1-(2-sulfamoylphenyl)-3-pyrazolyl]but-3-yn-2-yl]-1-hydroxyurea IUPAC Name: 1-[2-[5-(3-fluoro-4-methoxyphenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]but-3-yn-2-yl]-1-hydroxyurea Traditional Name: 1-[1-[5-(3-fluoro-4-methoxy-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-1-methyl-prop-2-ynyl]-1-hydroxy-urea Formula: C21H20FN5O5S MolecularWeight: 473.477403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)(C1=NN(C(=C1)C2=CC(=C(C=C2)OC)F)C3=CC=CC=C3S(=O)(=O)N)N(C(=O)N)O

Isomeric SMILES

CC(C#C)(C1=NN(C(=C1)C2=CC(=C(C=C2)OC)F)C3=CC=CC=C3S(=O)(=O)N)N(C(=O)N)O

InChI

InChI=1S/C21H20FN5O5S/c1-4-21(2,27(29)20(23)28)19-12-16(13-9-10-17(32-3)14(22)11-13)26(25-19)15-7-5-6-8-18(15)33(24,30)31/h1,5-12,29H,2-3H3,(H2,23,28)(H2,24,30,31)