4-fluoranyl-N'-[2-[3-(1-methoxypropan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]benzohydrazide

Systemtic Name: 4-fluoranyl-N'-[2-[3-(1-methoxypropan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]benzohydrazide Openeye Name: 4-fluoro-N'-[2-[3-(2-methoxy-1-methyl-ethyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]benzohydrazide CAS Name: 4-fluoro-N'-[2-[[3-(1-methoxypropan-2-yl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-fluoro-N'-[2-[3-(1-methoxypropan-2-yl)-4-oxoquinazolin-2-yl]sulfanylacetyl]benzohydrazide Traditional Name: 4-fluoro-N'-[2-[[4-keto-3-(2-methoxy-1-methyl-ethyl)quinazolin-2-yl]thio]acetyl]benzohydrazide Formula: C21H21FN4O4S MolecularWeight: 444.479243

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O4S/c1-13(11-30-2)26-20(29)16-5-3-4-6-17(16)23-21(26)31-12-18(27)24-25-19(28)14-7-9-15(22)10-8-14/h3-10,13H,11-12H2,1-2H3,(H,24,27)(H,25,28)