4-(4-pyridin-2-ylpiperazin-4-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine

Systemtic Name: 4-(4-pyridin-2-ylpiperazin-4-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine Openeye Name: 4-[4-(2-pyridyl)piperazin-4-ium-1-yl]benzofuro[3,2-d]pyrimidine CAS Name: 4-[4-(2-pyridinyl)-1-piperazin-4-iumyl]benzofuro[3,2-d]pyrimidine IUPAC Name: 4-(4-pyridin-2-ylpiperazin-4-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine Traditional Name: 4-[4-(2-pyridyl)piperazin-4-ium-1-yl]benzofuro[3,2-d]pyrimidine Formula: C19H18N5O+ MolecularWeight: 332.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2=CC=CC=N2)C3=NC=NC4=C3OC5=CC=CC=C54

Isomeric SMILES

C1CN(CC[NH+]1C2=CC=CC=N2)C3=NC=NC4=C3OC5=CC=CC=C54

InChI

InChI=1S/C19H17N5O/c1-2-6-15-14(5-1)17-18(25-15)19(22-13-21-17)24-11-9-23(10-12-24)16-7-3-4-8-20-16/h1-8,13H,9-12H2/p+1