N-[4-(2-azanyl-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[4-(2-azanyl-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[4-(2-amino-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[4-(2-amino-3-cyano-1-pyrrolo[3,2-b]quinoxalinyl)phenyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[4-(2-amino-3-cyanopyrrolo[3,2-b]quinoxalin-1-yl)phenyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[4-(2-amino-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]-3,4,5-trimethoxy-benzamide Formula: C27H22N6O4 MolecularWeight: 494.50138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=C(C=C2)N3C(=C(C4=NC5=CC=CC=C5N=C43)C#N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=C(C=C2)N3C(=C(C4=NC5=CC=CC=C5N=C43)C#N)N

InChI

InChI=1S/C27H22N6O4/c1-35-21-12-15(13-22(36-2)24(21)37-3)27(34)30-16-8-10-17(11-9-16)33-25(29)18(14-28)23-26(33)32-20-7-5-4-6-19(20)31-23/h4-13H,29H2,1-3H3,(H,30,34)