4-fluoranyl-N'-[2-[[3-(4-methylpyridin-2-yl)-4-oxidanylidene-1H-quinazolin-3-ium-2-yl]sulfanyl]ethanoyl]benzohydrazide

Systemtic Name: 4-fluoranyl-N'-[2-[[3-(4-methylpyridin-2-yl)-4-oxidanylidene-1H-quinazolin-3-ium-2-yl]sulfanyl]ethanoyl]benzohydrazide Openeye Name: 4-fluoro-N'-[2-[[3-(4-methyl-2-pyridyl)-4-oxo-1H-quinazolin-3-ium-2-yl]sulfanyl]acetyl]benzohydrazide CAS Name: 4-fluoro-N'-[2-[[3-(4-methyl-2-pyridinyl)-4-oxo-1H-quinazolin-3-ium-2-yl]thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-fluoro-N'-[2-[[3-(4-methylpyridin-2-yl)-4-oxo-1H-quinazolin-3-ium-2-yl]sulfanyl]acetyl]benzohydrazide Traditional Name: 4-fluoro-N'-[2-[[4-keto-3-(4-methyl-2-pyridyl)-1H-quinazolin-3-ium-2-yl]thio]acetyl]benzohydrazide Formula: C23H19FN5O3S+ MolecularWeight: 464.492063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)[N+]2=C(NC3=CC=CC=C3C2=O)SCC(=O)NNC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=NC=C1)[N+]2=C(NC3=CC=CC=C3C2=O)SCC(=O)NNC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H18FN5O3S/c1-14-10-11-25-19(12-14)29-22(32)17-4-2-3-5-18(17)26-23(29)33-13-20(30)27-28-21(31)15-6-8-16(24)9-7-15/h2-12H,13H2,1H3,(H2,27,28,30,31)/p+1