2-[(4-bromophenyl)sulfonylamino]-1-hexyl-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-1-hexyl-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-1-hexyl-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-1-hexyl-N-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-1-hexyl-N-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-(brosylamino)-1-hexyl-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C31H32BrN5O3S MolecularWeight: 634.58648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCCC4=CC=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCCC4=CC=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C31H32BrN5O3S/c1-2-3-4-10-21-37-29(36-41(39,40)24-17-15-23(32)16-18-24)27(31(38)33-20-19-22-11-6-5-7-12-22)28-30(37)35-26-14-9-8-13-25(26)34-28/h5-9,11-18,36H,2-4,10,19-21H2,1H3,(H,33,38)