N-[3-[(3R)-3-(3-methoxy-2-oxidanyl-phenyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[(3R)-3-(3-methoxy-2-oxidanyl-phenyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[(3R)-3-(2-hydroxy-3-methoxy-phenyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide CAS Name: N-[3-[(3R)-3-(2-hydroxy-3-methoxyphenyl)-2-(1-oxopropyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide IUPAC Name: N-[3-[(3R)-3-(2-hydroxy-3-methoxyphenyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[(5R)-5-(2-hydroxy-3-methoxy-phenyl)-1-propionyl-2-pyrazolin-3-yl]phenyl]methanesulfonamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=C(C(=CC=C3)OC)O

Isomeric SMILES

CCC(=O)N1[C@H](CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=C(C(=CC=C3)OC)O

InChI

InChI=1S/C20H23N3O5S/c1-4-19(24)23-17(15-9-6-10-18(28-2)20(15)25)12-16(21-23)13-7-5-8-14(11-13)22-29(3,26)27/h5-11,17,22,25H,4,12H2,1-3H3/t17-/m1/s1