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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5CCCO5)N

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5CCCO5)N

InChI

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