N'-(4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-(4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-(4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzoyl)-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[[4-fluoro-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-(4-fluoro-3-pyrrolidin-1-ylsulfonylbenzoyl)-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-(4-fluoro-3-pyrrolidinosulfonyl-benzoyl)-1,3-benzodioxole-5-carbohydrazide Formula: C19H18FN3O6S MolecularWeight: 435.426123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4)F

InChI

InChI=1S/C19H18FN3O6S/c20-14-5-3-13(10-17(14)30(26,27)23-7-1-2-8-23)19(25)22-21-18(24)12-4-6-15-16(9-12)29-11-28-15/h3-6,9-10H,1-2,7-8,11H2,(H,21,24)(H,22,25)