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

Systemtic Name: 3-chloranyl-N-[3-(3-methylbutylamino)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 3-chloro-N-[3-(isopentylamino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 3-chloro-N-[3-(3-methylbutylamino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 3-chloro-N-[3-(3-methylbutylamino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 3-chloro-N-[3-(isoamylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C19H21ClN4O2S MolecularWeight: 404.91364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN4O2S/c1-13(2)10-11-21-18-19(23-17-9-4-3-8-16(17)22-18)24-27(25,26)15-7-5-6-14(20)12-15/h3-9,12-13H,10-11H2,1-2H3,(H,21,22)(H,23,24)