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

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-(oxolan-3-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(p-tolylsulfonyl)-1-(tetrahydrofuran-3-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(4-methylphenyl)sulfonyl-1-(3-oxolanylmethyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-(oxolan-3-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-(tetrahydrofuran-3-ylmethyl)-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C22H22N4O3S MolecularWeight: 422.50008

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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)CC5CCOC5)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5CCOC5)N

InChI

InChI=1S/C22H22N4O3S/c1-14-6-8-16(9-7-14)30(27,28)20-19-22(25-18-5-3-2-4-17(18)24-19)26(21(20)23)12-15-10-11-29-13-15/h2-9,15H,10-13,23H2,1H3