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

Systemtic Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(3-methylbutyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(3,4-dimethylphenyl)sulfonyl-1-isopentyl-pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(3-methylbutyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(3,4-dimethylphenyl)sulfonyl-1-(3-methylbutyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [3-(3,4-dimethylphenyl)sulfonyl-1-isoamyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C23H26N4O2S MolecularWeight: 422.54314

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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)CCC(C)C)N)C

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2S/c1-14(2)11-12-27-22(24)21(30(28,29)17-10-9-15(3)16(4)13-17)20-23(27)26-19-8-6-5-7-18(19)25-20/h5-10,13-14H,11-12,24H2,1-4H3