N'-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoyl]-4-pyrrolidin-1-ylsulfonyl-benzohydrazide

Systemtic Name: N'-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoyl]-4-pyrrolidin-1-ylsulfonyl-benzohydrazide Openeye Name: N'-[2-(6-fluoro-4-oxo-quinazolin-3-yl)acetyl]-4-pyrrolidin-1-ylsulfonyl-benzohydrazide CAS Name: N'-[2-(6-fluoro-4-oxo-3-quinazolinyl)-1-oxoethyl]-4-(1-pyrrolidinylsulfonyl)benzohydrazide IUPAC Name: N'-[2-(6-fluoro-4-oxoquinazolin-3-yl)acetyl]-4-pyrrolidin-1-ylsulfonylbenzohydrazide Traditional Name: N'-[2-(6-fluoro-4-keto-quinazolin-3-yl)acetyl]-4-pyrrolidinosulfonyl-benzohydrazide Formula: C21H20FN5O5S MolecularWeight: 473.477403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C21H20FN5O5S/c22-15-5-8-18-17(11-15)21(30)26(13-23-18)12-19(28)24-25-20(29)14-3-6-16(7-4-14)33(31,32)27-9-1-2-10-27/h3-8,11,13H,1-2,9-10,12H2,(H,24,28)(H,25,29)