1-(3-fluoranyl-4-methylsulfonyl-phenyl)-5-[4-(furan-2-yl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-(3-fluoranyl-4-methylsulfonyl-phenyl)-5-[4-(furan-2-yl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-(3-fluoro-4-methylsulfonyl-phenyl)-5-[4-(2-furyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-(3-fluoro-4-methylsulfonylphenyl)-5-[4-(2-furanyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-(3-fluoro-4-methylsulfonylphenyl)-5-[4-(furan-2-yl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-(3-fluoro-4-mesyl-phenyl)-5-[4-(2-furyl)phenyl]pyrazole-3-carboxamide Formula: C21H16FN3O4S MolecularWeight: 425.432843

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)N)C3=CC=C(C=C3)C4=CC=CO4)F

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)N)C3=CC=C(C=C3)C4=CC=CO4)F

InChI

InChI=1S/C21H16FN3O4S/c1-30(27,28)20-9-8-15(11-16(20)22)25-18(12-17(24-25)21(23)26)13-4-6-14(7-5-13)19-3-2-10-29-19/h2-12H,1H3,(H2,23,26)