N-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[1-benzyl-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[1-benzyl-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-(1-benzyl-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl)-5-nitro-2-furamide Formula: C29H21N5O6S MolecularWeight: 567.57194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)NC(=O)C6=CC=C(O6)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)NC(=O)C6=CC=C(O6)[N+](=O)[O-]

InChI

InChI=1S/C29H21N5O6S/c1-18-11-13-20(14-12-18)41(38,39)26-25-27(31-22-10-6-5-9-21(22)30-25)33(17-19-7-3-2-4-8-19)28(26)32-29(35)23-15-16-24(40-23)34(36)37/h2-16H,17H2,1H3,(H,32,35)