3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N'-(4-fluorophenyl)benzohydrazide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N'-(4-fluorophenyl)benzohydrazide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N'-(4-fluorophenyl)benzohydrazide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N'-(4-fluorophenyl)benzohydrazide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N'-(4-fluorophenyl)benzohydrazide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N'-(4-fluorophenyl)benzohydrazide Formula: C22H20FN3O3S MolecularWeight: 425.475903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NNC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NNC4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O3S/c23-19-8-10-20(11-9-19)24-25-22(27)17-6-3-7-21(14-17)30(28,29)26-13-12-16-4-1-2-5-18(16)15-26/h1-11,14,24H,12-13,15H2,(H,25,27)