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

Systemtic Name: N-[3-(4-methylphenyl)sulfonyl-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: 5-nitro-N-[1-phenethyl-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]furan-2-carboxamide CAS Name: N-[3-(4-methylphenyl)sulfonyl-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-(4-methylphenyl)sulfonyl-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: 5-nitro-N-(1-phenethyl-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl)-2-furamide Formula: C30H23N5O6S MolecularWeight: 581.59852

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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)CCC5=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)CCC5=CC=CC=C5)NC(=O)C6=CC=C(O6)[N+](=O)[O-]

InChI

InChI=1S/C30H23N5O6S/c1-19-11-13-21(14-12-19)42(39,40)27-26-28(32-23-10-6-5-9-22(23)31-26)34(18-17-20-7-3-2-4-8-20)29(27)33-30(36)24-15-16-25(41-24)35(37)38/h2-16H,17-18H2,1H3,(H,33,36)