N-[(2S,3S,5S)-8-fluoranyl-1-(3-fluorophenyl)-8-methyl-3-oxidanyl-5-sulfamoyl-nonan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S,5S)-8-fluoranyl-1-(3-fluorophenyl)-8-methyl-3-oxidanyl-5-sulfamoyl-nonan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S,4S)-7-fluoro-1-[(3-fluorophenyl)methyl]-2-hydroxy-7-methyl-4-sulfamoyl-octyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S,5S)-8-fluoro-1-(3-fluorophenyl)-3-hydroxy-8-methyl-5-sulfamoylnonan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S,5S)-8-fluoro-1-(3-fluorophenyl)-3-hydroxy-8-methyl-5-sulfamoylnonan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S,4S)-7-fluoro-1-(3-fluorobenzyl)-2-hydroxy-7-methyl-4-sulfamoyl-octyl]quinoxaline-2-carboxamide Formula: C25H30F2N4O4S MolecularWeight: 520.591906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(CC(C(CC1=CC(=CC=C1)F)NC(=O)C2=NC3=CC=CC=C3N=C2)O)S(=O)(=O)N)F

Isomeric SMILES

CC(C)(CC[C@@H](C[C@@H]([C@H](CC1=CC(=CC=C1)F)NC(=O)C2=NC3=CC=CC=C3N=C2)O)S(=O)(=O)N)F

InChI

InChI=1S/C25H30F2N4O4S/c1-25(2,27)11-10-18(36(28,34)35)14-23(32)21(13-16-6-5-7-17(26)12-16)31-24(33)22-15-29-19-8-3-4-9-20(19)30-22/h3-9,12,15,18,21,23,32H,10-11,13-14H2,1-2H3,(H,31,33)(H2,28,34,35)/t18-,21-,23-/m0/s1