N-[[4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methyl]methanesulfonamide

Systemtic Name: N-[[4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methyl]methanesulfonamide Openeye Name: N-[[4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methyl]methanesulfonamide CAS Name: N-[[4-[2-(4-methoxyphenyl)-5-(2-methyl-1-oxopropyl)-3-pyrazolyl]phenyl]methyl]methanesulfonamide IUPAC Name: N-[[4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methyl]methanesulfonamide Traditional Name: N-[4-[5-isobutyryl-2-(4-methoxyphenyl)pyrazol-3-yl]benzyl]methanesulfonamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNS(=O)(=O)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNS(=O)(=O)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O4S/c1-15(2)22(26)20-13-21(25(24-20)18-9-11-19(29-3)12-10-18)17-7-5-16(6-8-17)14-23-30(4,27)28/h5-13,15,23H,14H2,1-4H3