4-[5-azanyl-6-(1-benzofuran-2-yl)pyrazin-2-yl]-N-[2,3-bis(oxidanyl)propyl]benzamide

Systemtic Name: 4-[5-azanyl-6-(1-benzofuran-2-yl)pyrazin-2-yl]-N-[2,3-bis(oxidanyl)propyl]benzamide Openeye Name: 4-[5-amino-6-(benzofuran-2-yl)pyrazin-2-yl]-N-(2,3-dihydroxypropyl)benzamide CAS Name: 4-[5-amino-6-(2-benzofuranyl)-2-pyrazinyl]-N-(2,3-dihydroxypropyl)benzamide IUPAC Name: 4-[5-amino-6-(1-benzofuran-2-yl)pyrazin-2-yl]-N-(2,3-dihydroxypropyl)benzamide Traditional Name: 4-[5-amino-6-(benzofuran-2-yl)pyrazin-2-yl]-N-glyceryl-benzamide Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C3=NC(=CN=C3N)C4=CC=C(C=C4)C(=O)NCC(CO)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C3=NC(=CN=C3N)C4=CC=C(C=C4)C(=O)NCC(CO)O

InChI

InChI=1S/C22H20N4O4/c23-21-20(19-9-15-3-1-2-4-18(15)30-19)26-17(11-24-21)13-5-7-14(8-6-13)22(29)25-10-16(28)12-27/h1-9,11,16,27-28H,10,12H2,(H2,23,24)(H,25,29)