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

Systemtic Name: 3-(3-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-isobutyl-3-(m-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(3-methylphenyl)sulfonyl-1-(2-methylpropyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(3-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-isobutyl-3-(m-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2S/c1-13(2)12-25-20(22)19(28(26,27)15-8-6-7-14(3)11-15)18-21(25)24-17-10-5-4-9-16(17)23-18/h4-11,13H,12,22H2,1-3H3