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

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-(2-phenylsulfanylethyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-(2-phenylsulfanylethyl)-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(4-methylphenyl)sulfonyl-1-[2-(phenylthio)ethyl]-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-(2-phenylsulfanylethyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-[2-(phenylthio)ethyl]-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C25H22N4O2S2 MolecularWeight: 474.59778

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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)CCSC5=CC=CC=C5)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCSC5=CC=CC=C5)N

InChI

InChI=1S/C25H22N4O2S2/c1-17-11-13-19(14-12-17)33(30,31)23-22-25(28-21-10-6-5-9-20(21)27-22)29(24(23)26)15-16-32-18-7-3-2-4-8-18/h2-14H,15-16,26H2,1H3