N'-[2-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[2-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[2-(7-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-4-fluoro-benzohydrazide CAS Name: N'-[2-[[7-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-4-fluorobenzohydrazide IUPAC Name: N'-[2-[7-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-4-fluorobenzohydrazide Traditional Name: N'-[2-[(7-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]acetyl]-4-fluoro-benzohydrazide Formula: C21H20ClFN4O3S MolecularWeight: 462.924903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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