N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]-2-methyl-propan-2-amine

Systemtic Name: N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]-2-methyl-propan-2-amine Openeye Name: N-[[(2Z)-2-[5-(4-isoquinolyl)-1,2-dihydroindazol-3-ylidene]benzimidazol-4-yl]methyl]-2-methyl-propan-2-amine CAS Name: N-[[(2Z)-2-[5-(4-isoquinolinyl)-1,2-dihydroindazol-3-ylidene]-4-benzimidazolyl]methyl]-2-methyl-2-propanamine IUPAC Name: N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]-2-methylpropan-2-amine Traditional Name: tert-butyl-[[(2Z)-2-[5-(4-isoquinolyl)indazolin-3-ylidene]benzimidazol-4-yl]methyl]amine Formula: C28H26N6 MolecularWeight: 446.54624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1=CC=CC2=NC(=C3C4=C(C=CC(=C4)C5=CN=CC6=CC=CC=C65)NN3)N=C21

Isomeric SMILES

CC(C)(C)NCC1=CC=CC2=N/C(=C/3\C4=C(C=CC(=C4)C5=CN=CC6=CC=CC=C65)NN3)/N=C21

InChI

InChI=1S/C28H26N6/c1-28(2,3)30-15-19-8-6-10-24-25(19)32-27(31-24)26-21-13-17(11-12-23(21)33-34-26)22-16-29-14-18-7-4-5-9-20(18)22/h4-14,16,30,33-34H,15H2,1-3H3/b27-26-