4-fluoranyl-N-[3-(3-methylbutylamino)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-(3-methylbutylamino)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-(isopentylamino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-(3-methylbutylamino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-(3-methylbutylamino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-(isoamylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C19H21FN4O2S MolecularWeight: 388.459043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC2=CC=CC=C2N=C1NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCNC1=NC2=CC=CC=C2N=C1NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN4O2S/c1-13(2)11-12-21-18-19(23-17-6-4-3-5-16(17)22-18)24-27(25,26)15-9-7-14(20)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,21,22)(H,23,24)