(3E)-3-[[2-(3-chlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]hydrazinylidene]-4-oxidanylidene-N-(3-propan-2-yloxypropyl)cyclohexa-1,5-diene-1-sulfonamide

Systemtic Name: (3E)-3-[[2-(3-chlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]hydrazinylidene]-4-oxidanylidene-N-(3-propan-2-yloxypropyl)cyclohexa-1,5-diene-1-sulfonamide Openeye Name: (3E)-3-[[2-(3-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazono]-N-(3-isopropoxypropyl)-4-oxo-cyclohexa-1,5-diene-1-sulfonamide CAS Name: (3E)-3-[[2-(3-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazinylidene]-4-oxo-N-(3-propan-2-yloxypropyl)-1-cyclohexa-1,5-dienesulfonamide IUPAC Name: (3E)-3-[[2-(3-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazinylidene]-4-oxo-N-(3-propan-2-yloxypropyl)cyclohexa-1,5-diene-1-sulfonamide Traditional Name: (3E)-3-[[1-(3-chlorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]hydrazono]-N-(3-isopropoxypropyl)-4-keto-cyclohexa-1,5-diene-1-sulfonamide Formula: C22H26ClN5O5S MolecularWeight: 507.99034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC(=CC=C2)Cl)NN=C3C=C(C=CC3=O)S(=O)(=O)NCCCOC(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC(=CC=C2)Cl)N/N=C/3\C=C(C=CC3=O)S(=O)(=O)NCCCOC(C)C

InChI

InChI=1S/C22H26ClN5O5S/c1-14(2)33-11-5-10-24-34(31,32)18-8-9-20(29)19(13-18)25-26-21-15(3)27-28(22(21)30)17-7-4-6-16(23)12-17/h4,6-9,12-14,24,26-27H,5,10-11H2,1-3H3/b25-19+