1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: (1-piperonyl-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl)amine Formula: C25H20N4O4S MolecularWeight: 472.5157

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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)CC5=CC6=C(C=C5)OCO6)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC6=C(C=C5)OCO6)N

InChI

InChI=1S/C25H20N4O4S/c1-15-6-9-17(10-7-15)34(30,31)23-22-25(28-19-5-3-2-4-18(19)27-22)29(24(23)26)13-16-8-11-20-21(12-16)33-14-32-20/h2-12H,13-14,26H2,1H3