N'-[2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-2-fluoranyl-benzohydrazide

Systemtic Name: N'-[2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-2-fluoranyl-benzohydrazide Openeye Name: N'-[2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-2-fluoro-benzohydrazide CAS Name: N'-[2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-2-fluorobenzohydrazide IUPAC Name: N'-[2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-2-fluorobenzohydrazide Traditional Name: N'-[2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]acetyl]-2-fluoro-benzohydrazide Formula: C21H20ClFN4O3S MolecularWeight: 462.924903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H20ClFN4O3S/c1-12(2)10-27-20(30)15-9-13(22)7-8-17(15)24-21(27)31-11-18(28)25-26-19(29)14-5-3-4-6-16(14)23/h3-9,12H,10-11H2,1-2H3,(H,25,28)(H,26,29)