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

Systemtic Name: N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]-N-methyl-ethanamine Openeye Name: N-[[(2Z)-2-[5-(4-isoquinolyl)-1,2-dihydroindazol-3-ylidene]benzimidazol-4-yl]methyl]-N-methyl-ethanamine CAS Name: N-[[(2Z)-2-[5-(4-isoquinolinyl)-1,2-dihydroindazol-3-ylidene]-4-benzimidazolyl]methyl]-N-methylethanamine IUPAC Name: N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]-N-methylethanamine Traditional Name: ethyl-[[(2Z)-2-[5-(4-isoquinolyl)indazolin-3-ylidene]benzimidazol-4-yl]methyl]-methyl-amine Formula: C27H24N6 MolecularWeight: 432.51966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)CC1=CC=CC2=NC(=C3C4=C(C=CC(=C4)C5=CN=CC6=CC=CC=C65)NN3)N=C21

Isomeric SMILES

CCN(C)CC1=CC=CC2=N/C(=C/3\C4=C(C=CC(=C4)C5=CN=CC6=CC=CC=C65)NN3)/N=C21

InChI

InChI=1S/C27H24N6/c1-3-33(2)16-19-8-6-10-24-25(19)30-27(29-24)26-21-13-17(11-12-23(21)31-32-26)22-15-28-14-18-7-4-5-9-20(18)22/h4-15,31-32H,3,16H2,1-2H3/b27-26-