N'-[6-fluoranyl-1,1-bis(oxidanylidene)-2H-thiochromen-4-yl]-3-piperidin-1-ylsulfonyl-benzohydrazide

Systemtic Name: N'-[6-fluoranyl-1,1-bis(oxidanylidene)-2H-thiochromen-4-yl]-3-piperidin-1-ylsulfonyl-benzohydrazide Openeye Name: N'-(6-fluoro-1,1-dioxo-2H-thiochromen-4-yl)-3-(1-piperidylsulfonyl)benzohydrazide CAS Name: N'-(6-fluoro-1,1-dioxo-2H-1-benzothiopyran-4-yl)-3-(1-piperidinylsulfonyl)benzohydrazide IUPAC Name: N'-(6-fluoro-1,1-dioxo-2H-thiochromen-4-yl)-3-piperidin-1-ylsulfonylbenzohydrazide Traditional Name: N'-(6-fluoro-1,1-diketo-2H-thiochromen-4-yl)-3-piperidinosulfonyl-benzohydrazide Formula: C21H22FN3O5S2 MolecularWeight: 479.544883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC3=CCS(=O)(=O)C4=C3C=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC3=CCS(=O)(=O)C4=C3C=C(C=C4)F

InChI

InChI=1S/C21H22FN3O5S2/c22-16-7-8-20-18(14-16)19(9-12-31(20,27)28)23-24-21(26)15-5-4-6-17(13-15)32(29,30)25-10-2-1-3-11-25/h4-9,13-14,23H,1-3,10-12H2,(H,24,26)