4-nitro-N-[1-phenethyl-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[1-phenethyl-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(benzenesulfonyl)-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(benzenesulfonyl)-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(benzenesulfonyl)-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-(3-besyl-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)-4-nitro-benzenesulfonamide Formula: C30H23N5O6S2 MolecularWeight: 613.66352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)NS(=O)(=O)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)NS(=O)(=O)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C30H23N5O6S2/c36-35(37)22-15-17-24(18-16-22)43(40,41)33-30-28(42(38,39)23-11-5-2-6-12-23)27-29(32-26-14-8-7-13-25(26)31-27)34(30)20-19-21-9-3-1-4-10-21/h1-18,33H,19-20H2