2-chloranyl-N-[1-pentyl-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-pentyl-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: N-[3-(benzenesulfonyl)-1-pentyl-pyrrolo[3,2-b]quinoxalin-2-yl]-2-chloro-benzamide CAS Name: N-[3-(benzenesulfonyl)-1-pentyl-2-pyrrolo[3,2-b]quinoxalinyl]-2-chlorobenzamide IUPAC Name: N-[3-(benzenesulfonyl)-1-pentylpyrrolo[3,2-b]quinoxalin-2-yl]-2-chlorobenzamide Traditional Name: N-(1-amyl-3-besyl-pyrrolo[3,2-b]quinoxalin-2-yl)-2-chloro-benzamide Formula: C28H25ClN4O3S MolecularWeight: 533.0411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C28H25ClN4O3S/c1-2-3-11-18-33-26-24(30-22-16-9-10-17-23(22)31-26)25(37(35,36)19-12-5-4-6-13-19)27(33)32-28(34)20-14-7-8-15-21(20)29/h4-10,12-17H,2-3,11,18H2,1H3,(H,32,34)