4-[(6-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)methyl]-2,1,3-benzoxadiazole

Systemtic Name: 4-[(6-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)methyl]-2,1,3-benzoxadiazole Openeye Name: 4-[(6-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)methyl]-2,1,3-benzoxadiazole CAS Name: 4-[[6-(1-piperazinyl)-1-pyrrolo[3,2-b]pyridinyl]methyl]-2,1,3-benzoxadiazole IUPAC Name: 4-[(6-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)methyl]-2,1,3-benzoxadiazole Traditional Name: 4-[(6-piperazinopyrrolo[3,2-b]pyridin-1-yl)methyl]benzofurazan Formula: C18H18N6O MolecularWeight: 334.37512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CN=C3C=CN(C3=C2)CC4=CC=CC5=NON=C54

Isomeric SMILES

C1CN(CCN1)C2=CN=C3C=CN(C3=C2)CC4=CC=CC5=NON=C54

InChI

InChI=1S/C18H18N6O/c1-2-13(18-16(3-1)21-25-22-18)12-24-7-4-15-17(24)10-14(11-20-15)23-8-5-19-6-9-23/h1-4,7,10-11,19H,5-6,8-9,12H2