N'-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyl-2-fluoranyl-benzohydrazide

Systemtic Name: N'-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyl-2-fluoranyl-benzohydrazide Openeye Name: N'-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-2-fluoro-benzohydrazide CAS Name: N'-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethyl]-2-fluorobenzohydrazide IUPAC Name: N'-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-2-fluorobenzohydrazide Traditional Name: N'-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-2-fluoro-benzohydrazide Formula: C23H20FN3O4S MolecularWeight: 453.486003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NNC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NNC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H20FN3O4S/c24-21-8-4-3-7-20(21)23(29)26-25-22(28)17-9-11-19(12-10-17)32(30,31)27-14-13-16-5-1-2-6-18(16)15-27/h1-12H,13-15H2,(H,25,28)(H,26,29)