3-(2,5-dimethylphenyl)sulfonyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 3-(2,5-dimethylphenyl)sulfonyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-benzyl-3-(2,5-dimethylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(2,5-dimethylphenyl)sulfonyl-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 1-benzyl-3-(2,5-dimethylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-benzyl-3-(2,5-dimethylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C25H22N4O2S MolecularWeight: 442.53278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)N

InChI

InChI=1S/C25H22N4O2S/c1-16-12-13-17(2)21(14-16)32(30,31)23-22-25(28-20-11-7-6-10-19(20)27-22)29(24(23)26)15-18-8-4-3-5-9-18/h3-14H,15,26H2,1-2H3