4-[3,5-bis(azanyl)phenyl]-N-[(3-methoxyquinoxalin-2-yl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-[3,5-bis(azanyl)phenyl]-N-[(3-methoxyquinoxalin-2-yl)methyl]piperazine-1-carboxamide Openeye Name: 4-(3,5-diaminophenyl)-N-[(3-methoxyquinoxalin-2-yl)methyl]piperazine-1-carboxamide CAS Name: 4-(3,5-diaminophenyl)-N-[(3-methoxy-2-quinoxalinyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(3,5-diaminophenyl)-N-[(3-methoxyquinoxalin-2-yl)methyl]piperazine-1-carboxamide Traditional Name: 4-(3,5-diaminophenyl)-N-[(3-methoxyquinoxalin-2-yl)methyl]piperazine-1-carboxamide Formula: C21H25N7O2 MolecularWeight: 407.4689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=CC=C2N=C1CNC(=O)N3CCN(CC3)C4=CC(=CC(=C4)N)N

Isomeric SMILES

COC1=NC2=CC=CC=C2N=C1CNC(=O)N3CCN(CC3)C4=CC(=CC(=C4)N)N

InChI

InChI=1S/C21H25N7O2/c1-30-20-19(25-17-4-2-3-5-18(17)26-20)13-24-21(29)28-8-6-27(7-9-28)16-11-14(22)10-15(23)12-16/h2-5,10-12H,6-9,13,22-23H2,1H3,(H,24,29)