N-[3-(4-methylphenyl)sulfonyl-1-(oxolan-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-methylphenyl)sulfonyl-1-(oxolan-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide Openeye Name: 4-nitro-N-[3-(p-tolylsulfonyl)-1-(tetrahydrofuran-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(4-methylphenyl)sulfonyl-1-(2-oxolanylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-methylphenyl)sulfonyl-1-(oxolan-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitrobenzenesulfonamide Traditional Name: 4-nitro-N-[1-(tetrahydrofurfuryl)-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Formula: C28H25N5O7S2 MolecularWeight: 607.6574

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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)CC5CCCO5)NS(=O)(=O)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5CCCO5)NS(=O)(=O)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C28H25N5O7S2/c1-18-8-12-21(13-9-18)41(36,37)26-25-27(30-24-7-3-2-6-23(24)29-25)32(17-20-5-4-16-40-20)28(26)31-42(38,39)22-14-10-19(11-15-22)33(34)35/h2-3,6-15,20,31H,4-5,16-17H2,1H3