N-[3-[(4-butylphenyl)amino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[3-[(4-butylphenyl)amino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[3-(4-butylanilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-(4-butylanilino)-2-quinoxalinyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-(4-butylanilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[3-(4-butylanilino)quinoxalin-2-yl]piazthiole-4-sulfonamide Formula: C24H22N6O2S2 MolecularWeight: 490.60048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C24H22N6O2S2/c1-2-3-7-16-12-14-17(15-13-16)25-23-24(27-19-9-5-4-8-18(19)26-23)30-34(31,32)21-11-6-10-20-22(21)29-33-28-20/h4-6,8-15H,2-3,7H2,1H3,(H,25,26)(H,27,30)