(3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazole-5-carboxylic acid

Systemtic Name: (3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazole-5-carboxylic acid Openeye Name: (3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazole-5-carboxylic acid CAS Name: (3Z)-3-[5-(4-methyl-1-piperazinyl)-2-benzimidazolylidene]-1,2-dihydroindazole-5-carboxylic acid IUPAC Name: (3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazole-5-carboxylic acid Traditional Name: (3Z)-3-[5-(4-methylpiperazino)benzimidazol-2-ylidene]indazoline-5-carboxylic acid Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=NC(=C4C5=C(C=CC(=C5)C(=O)O)NN4)N=C3C=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H20N6O2/c1-25-6-8-26(9-7-25)13-3-5-16-17(11-13)22-19(21-16)18-14-10-12(20(27)28)2-4-15(14)23-24-18/h2-5,10-11,23-24H,6-9H2,1H3,(H,27,28)/b19-18-