5-bromanyl-N-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[3-[4-(2-hydroxyphenyl)-1-piperazinyl]-2-quinoxalinyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-[3-[4-(2-hydroxyphenyl)piperazino]quinoxalin-2-yl]thiophene-2-sulfonamide Formula: C22H20BrN5O3S2 MolecularWeight: 546.4599

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2O)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(S5)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2O)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(S5)Br

InChI

InChI=1S/C22H20BrN5O3S2/c23-19-9-10-20(32-19)33(30,31)26-21-22(25-16-6-2-1-5-15(16)24-21)28-13-11-27(12-14-28)17-7-3-4-8-18(17)29/h1-10,29H,11-14H2,(H,24,26)