2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[2-(3-pyridyl)quinazolin-4-yl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-(3-pyridinyl)-4-quinazolinyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[2-(3-pyridyl)quinazolin-4-yl]piperazin-1-ium-1-yl]acetamide Formula: C19H21N6O+ MolecularWeight: 349.40964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C19H20N6O/c20-17(26)13-24-8-10-25(11-9-24)19-15-5-1-2-6-16(15)22-18(23-19)14-4-3-7-21-12-14/h1-7,12H,8-11,13H2,(H2,20,26)/p+1