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

Systemtic Name: 4-[2-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]ethyl]benzenesulfonamide Openeye Name: 4-[2-[2-amino-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-1-yl]ethyl]benzenesulfonamide CAS Name: 4-[2-[2-amino-3-(4-methylphenyl)sulfonyl-1-pyrrolo[3,2-b]quinoxalinyl]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[2-amino-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-1-yl]ethyl]benzenesulfonamide Traditional Name: 4-[2-(2-amino-3-tosyl-pyrrolo[3,2-b]quinoxalin-1-yl)ethyl]benzenesulfonamide Formula: C25H23N5O4S2 MolecularWeight: 521.61122

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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=C(C=C5)S(=O)(=O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCC5=CC=C(C=C5)S(=O)(=O)N)N

InChI

InChI=1S/C25H23N5O4S2/c1-16-6-10-18(11-7-16)35(31,32)23-22-25(29-21-5-3-2-4-20(21)28-22)30(24(23)26)15-14-17-8-12-19(13-9-17)36(27,33)34/h2-13H,14-15,26H2,1H3,(H2,27,33,34)