4-chloranyl-N-[4-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide Openeye Name: 4-chloro-N-[4-[3-(2-furyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide CAS Name: 4-chloro-N-[4-[3-(2-furanyl)-2-(1-oxopropyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[4-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide Traditional Name: 4-chloro-N-[4-[5-(2-furyl)-1-propionyl-2-pyrazolin-3-yl]phenyl]benzenesulfonamide Formula: C22H20ClN3O4S MolecularWeight: 457.9299

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CO4

Isomeric SMILES

CCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CO4

InChI

InChI=1S/C22H20ClN3O4S/c1-2-22(27)26-20(21-4-3-13-30-21)14-19(24-26)15-5-9-17(10-6-15)25-31(28,29)18-11-7-16(23)8-12-18/h3-13,20,25H,2,14H2,1H3