2-[[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]oxy]pyridine-3-carbonitrile

Systemtic Name: 2-[[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]oxy]pyridine-3-carbonitrile Openeye Name: 2-[[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]oxy]pyridine-3-carbonitrile CAS Name: 2-[[(3E)-3-[5-(4-methyl-1-piperazinyl)-2-benzimidazolylidene]-1,2-dihydroindazol-4-yl]oxy]-3-pyridinecarbonitrile IUPAC Name: 2-[[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]oxy]pyridine-3-carbonitrile Traditional Name: 2-[(3E)-3-[5-(4-methylpiperazino)benzimidazol-2-ylidene]indazolin-4-yl]oxynicotinonitrile Formula: C25H22N8O MolecularWeight: 450.49518

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=NC(=C4C5=C(C=CC=C5OC6=C(C=CC=N6)C#N)NN4)N=C3C=C2

Isomeric SMILES

CN1CCN(CC1)C2=CC3=N/C(=C/4\C5=C(C=CC=C5OC6=C(C=CC=N6)C#N)NN4)/N=C3C=C2

InChI

InChI=1S/C25H22N8O/c1-32-10-12-33(13-11-32)17-7-8-18-20(14-17)29-24(28-18)23-22-19(30-31-23)5-2-6-21(22)34-25-16(15-26)4-3-9-27-25/h2-9,14,30-31H,10-13H2,1H3/b24-23+