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

Systemtic Name: N-[3-(4-methylphenyl)sulfonyl-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[1-(1-phenylethyl)-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(4-methylphenyl)sulfonyl-1-(1-phenylethyl)-2-pyrrolo[3,2-b]quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(4-methylphenyl)sulfonyl-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[1-(1-phenylethyl)-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Formula: C31H26N4O4S2 MolecularWeight: 582.69254

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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)C(C)C5=CC=CC=C5)NS(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C(C)C5=CC=CC=C5)NS(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H26N4O4S2/c1-21-17-19-24(20-18-21)40(36,37)29-28-30(33-27-16-10-9-15-26(27)32-28)35(22(2)23-11-5-3-6-12-23)31(29)34-41(38,39)25-13-7-4-8-14-25/h3-20,22,34H,1-2H3