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

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(p-tolylsulfonyl)-1-(2-thienylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(4-methylphenyl)sulfonyl-1-(thiophen-2-ylmethyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-(2-thenyl)-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C22H18N4O2S2 MolecularWeight: 434.53392

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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=CC=CS5)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CS5)N

InChI

InChI=1S/C22H18N4O2S2/c1-14-8-10-16(11-9-14)30(27,28)20-19-22(25-18-7-3-2-6-17(18)24-19)26(21(20)23)13-15-5-4-12-29-15/h2-12H,13,23H2,1H3