N-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]-4-methyl-benzamide

Systemtic Name: N-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]-4-methyl-benzamide Openeye Name: N-[2-amino-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-1-yl]-4-methyl-benzamide CAS Name: N-[2-amino-3-(4-methylphenyl)sulfonyl-1-pyrrolo[3,2-b]quinoxalinyl]-4-methylbenzamide IUPAC Name: N-[2-amino-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-1-yl]-4-methylbenzamide Traditional Name: N-(2-amino-3-tosyl-pyrrolo[3,2-b]quinoxalin-1-yl)-4-methyl-benzamide Formula: C25H21N5O3S MolecularWeight: 471.53094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=C(C=C5)C)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=C(C=C5)C)N

InChI

InChI=1S/C25H21N5O3S/c1-15-7-11-17(12-8-15)25(31)29-30-23(26)22(34(32,33)18-13-9-16(2)10-14-18)21-24(30)28-20-6-4-3-5-19(20)27-21/h3-14H,26H2,1-2H3,(H,29,31)