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

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-tridecyl-pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(p-tolylsulfonyl)-1-tridecyl-pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(4-methylphenyl)sulfonyl-1-tridecyl-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-tridecylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: (3-tosyl-1-tridecyl-pyrrolo[3,2-b]quinoxalin-2-yl)amine Formula: C30H40N4O2S MolecularWeight: 520.7292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)N

Isomeric SMILES

CCCCCCCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)N

InChI

InChI=1S/C30H40N4O2S/c1-3-4-5-6-7-8-9-10-11-12-15-22-34-29(31)28(37(35,36)24-20-18-23(2)19-21-24)27-30(34)33-26-17-14-13-16-25(26)32-27/h13-14,16-21H,3-12,15,22,31H2,1-2H3