4-fluoranyl-N-[4-methyl-1-[[1-(1-oxidanidylpyridin-1-ium-2-yl)sulfonylazepan-4-yl]amino]-4-oxidanyl-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[4-methyl-1-[[1-(1-oxidanidylpyridin-1-ium-2-yl)sulfonylazepan-4-yl]amino]-4-oxidanyl-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: 4-fluoro-N-[3-hydroxy-3-methyl-1-[[1-(1-oxidopyridin-1-ium-2-yl)sulfonylazepan-4-yl]carbamoyl]butyl]benzamide CAS Name: 4-fluoro-N-[4-hydroxy-4-methyl-1-[[1-[(1-oxido-2-pyridin-1-iumyl)sulfonyl]-4-azepanyl]amino]-1-oxopentan-2-yl]benzamide IUPAC Name: 4-fluoro-N-[4-hydroxy-4-methyl-1-[[1-(1-oxidopyridin-1-ium-2-yl)sulfonylazepan-4-yl]amino]-1-oxopentan-2-yl]benzamide Traditional Name: 4-fluoro-N-[3-hydroxy-3-methyl-1-[[1-(1-oxidopyridin-1-ium-2-yl)sulfonylazepan-4-yl]carbamoyl]butyl]benzamide Formula: C24H31FN4O6S MolecularWeight: 522.589543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(=O)NC1CCCN(CC1)S(=O)(=O)C2=CC=CC=[N+]2[O-])NC(=O)C3=CC=C(C=C3)F)O

Isomeric SMILES

CC(C)(CC(C(=O)NC1CCCN(CC1)S(=O)(=O)C2=CC=CC=[N+]2[O-])NC(=O)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C24H31FN4O6S/c1-24(2,32)16-20(27-22(30)17-8-10-18(25)11-9-17)23(31)26-19-6-5-13-28(15-12-19)36(34,35)21-7-3-4-14-29(21)33/h3-4,7-11,14,19-20,32H,5-6,12-13,15-16H2,1-2H3,(H,26,31)(H,27,30)