N-[2-[3-(2-hydroxyphenyl)-2-(2-methylpropanoyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide

Systemtic Name: N-[2-[3-(2-hydroxyphenyl)-2-(2-methylpropanoyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide Openeye Name: N-[2-[3-(2-hydroxyphenyl)-2-(2-methylpropanoyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide CAS Name: N-[2-[3-(2-hydroxyphenyl)-2-(2-methyl-1-oxopropyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide IUPAC Name: N-[2-[3-(2-hydroxyphenyl)-2-(2-methylpropanoyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide Traditional Name: N-[2-[5-(2-hydroxyphenyl)-1-isobutyryl-2-pyrazolin-3-yl]phenyl]methanesulfonamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(CC(=N1)C2=CC=CC=C2NS(=O)(=O)C)C3=CC=CC=C3O

Isomeric SMILES

CC(C)C(=O)N1C(CC(=N1)C2=CC=CC=C2NS(=O)(=O)C)C3=CC=CC=C3O

InChI

InChI=1S/C20H23N3O4S/c1-13(2)20(25)23-18(15-9-5-7-11-19(15)24)12-17(21-23)14-8-4-6-10-16(14)22-28(3,26)27/h4-11,13,18,22,24H,12H2,1-3H3