1-(4-fluorophenyl)-2,5-dimethyl-N'-[3-(methylsulfonylmethyl)phenyl]carbonyl-pyrrole-3-carbohydrazide

Systemtic Name: 1-(4-fluorophenyl)-2,5-dimethyl-N'-[3-(methylsulfonylmethyl)phenyl]carbonyl-pyrrole-3-carbohydrazide Openeye Name: 1-(4-fluorophenyl)-2,5-dimethyl-N'-[3-(methylsulfonylmethyl)benzoyl]pyrrole-3-carbohydrazide CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-N'-[[3-(methylsulfonylmethyl)phenyl]-oxomethyl]-3-pyrrolecarbohydrazide IUPAC Name: 1-(4-fluorophenyl)-2,5-dimethyl-N'-[3-(methylsulfonylmethyl)benzoyl]pyrrole-3-carbohydrazide Traditional Name: 1-(4-fluorophenyl)-N'-[3-(mesylmethyl)benzoyl]-2,5-dimethyl-pyrrole-3-carbohydrazide Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)NNC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)NNC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

InChI

InChI=1S/C22H22FN3O4S/c1-14-11-20(15(2)26(14)19-9-7-18(23)8-10-19)22(28)25-24-21(27)17-6-4-5-16(12-17)13-31(3,29)30/h4-12H,13H2,1-3H3,(H,24,27)(H,25,28)