4-fluoranyl-3-[2-(2-methyl-4-pyridin-2-ylcarbonyl-piperazin-1-yl)-2-oxidanylidene-ethanoyl]-N'-oxidanyl-1H-indole-7-carboximidamide

Systemtic Name: 4-fluoranyl-3-[2-(2-methyl-4-pyridin-2-ylcarbonyl-piperazin-1-yl)-2-oxidanylidene-ethanoyl]-N'-oxidanyl-1H-indole-7-carboximidamide Openeye Name: 4-fluoro-N'-hydroxy-3-[2-[2-methyl-4-(pyridine-2-carbonyl)piperazin-1-yl]-2-oxo-acetyl]-1H-indole-7-carboxamidine CAS Name: 4-fluoro-N'-hydroxy-3-[2-[2-methyl-4-[oxo(2-pyridinyl)methyl]-1-piperazinyl]-1,2-dioxoethyl]-1H-indole-7-carboximidamide IUPAC Name: 4-fluoro-N'-hydroxy-3-[2-[2-methyl-4-(pyridine-2-carbonyl)piperazin-1-yl]-2-oxoacetyl]-1H-indole-7-carboximidamide Traditional Name: 4-fluoro-N'-hydroxy-3-[2-keto-2-(2-methyl-4-picolinoyl-piperazino)acetyl]-1H-indole-7-carboxamidine Formula: C22H21FN6O4 MolecularWeight: 452.438343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(=O)C2=CNC3=C(C=CC(=C23)F)C(=NO)N)C(=O)C4=CC=CC=N4

Isomeric SMILES

CC1CN(CCN1C(=O)C(=O)C2=CNC3=C(C=CC(=C23)F)/C(=N\O)/N)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C22H21FN6O4/c1-12-11-28(21(31)16-4-2-3-7-25-16)8-9-29(12)22(32)19(30)14-10-26-18-13(20(24)27-33)5-6-15(23)17(14)18/h2-7,10,12,26,33H,8-9,11H2,1H3,(H2,24,27)