N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-4-propyl-benzenesulfonamide

Systemtic Name: N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-4-propyl-benzenesulfonamide Openeye Name: N-(5-isopropyl-1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-propyl-benzenesulfonamide CAS Name: N-(1-methyl-3-oxo-2-phenyl-5-propan-2-yl-4-pyrazolyl)-4-propylbenzenesulfonamide IUPAC Name: N-(1-methyl-3-oxo-2-phenyl-5-propan-2-ylpyrazol-4-yl)-4-propylbenzenesulfonamide Traditional Name: N-(5-isopropyl-3-keto-1-methyl-2-phenyl-3-pyrazolin-4-yl)-4-propyl-benzenesulfonamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C(C)C

InChI

InChI=1S/C22H27N3O3S/c1-5-9-17-12-14-19(15-13-17)29(27,28)23-20-21(16(2)3)24(4)25(22(20)26)18-10-7-6-8-11-18/h6-8,10-16,23H,5,9H2,1-4H3