3-(3,4-dimethylphenyl)sulfonyl-1-(4-propan-2-ylphenyl)pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(4-propan-2-ylphenyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(4-isopropylphenyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(4-propan-2-ylphenyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(4-propan-2-ylphenyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [3-(3,4-dimethylphenyl)sulfonyl-1-p-cumenyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O2S/c1-16(2)19-10-12-20(13-11-19)31-26(28)25(34(32,33)21-14-9-17(3)18(4)15-21)24-27(31)30-23-8-6-5-7-22(23)29-24/h5-16H,28H2,1-4H3