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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(m-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-methylphenyl)sulfonyl-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [3-(m-tolylsulfonyl)-1-piperonyl-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(=CC=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC6=C(C=C5)OCO6)N

Isomeric SMILES

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

InChI

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