4-chloranyl-N-[3-(4-methylphenyl)sulfonyl-1-octan-3-yl-pyrrolo[3,2-b]quinoxalin-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[3-(4-methylphenyl)sulfonyl-1-octan-3-yl-pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: 4-chloro-N-[1-(1-ethylhexyl)-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide CAS Name: 4-chloro-N-[3-(4-methylphenyl)sulfonyl-1-octan-3-yl-2-pyrrolo[3,2-b]quinoxalinyl]benzamide IUPAC Name: 4-chloro-N-[3-(4-methylphenyl)sulfonyl-1-octan-3-ylpyrrolo[3,2-b]quinoxalin-2-yl]benzamide Traditional Name: 4-chloro-N-[1-(1-ethylhexyl)-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Formula: C32H33ClN4O3S MolecularWeight: 589.14742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)N1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)NC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCCCCC(CC)N1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)NC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C32H33ClN4O3S/c1-4-6-7-10-24(5-2)37-30-28(34-26-11-8-9-12-27(26)35-30)29(41(39,40)25-19-13-21(3)14-20-25)31(37)36-32(38)22-15-17-23(33)18-16-22/h8-9,11-20,24H,4-7,10H2,1-3H3,(H,36,38)