N-[3-(cyclopentylamino)quinoxalin-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[3-(cyclopentylamino)quinoxalin-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[3-(cyclopentylamino)quinoxalin-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[3-(cyclopentylamino)-2-quinoxalinyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[3-(cyclopentylamino)quinoxalin-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[3-(cyclopentylamino)quinoxalin-2-yl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCC(C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H22N4O4S/c26-30(27,15-9-10-18-19(13-15)29-12-11-28-18)25-21-20(22-14-5-1-2-6-14)23-16-7-3-4-8-17(16)24-21/h3-4,7-10,13-14H,1-2,5-6,11-12H2,(H,22,23)(H,24,25)