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

Systemtic Name: N-ethyl-N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]ethanamine Openeye Name: N-ethyl-N-[[(2Z)-2-[5-(4-isoquinolyl)-1,2-dihydroindazol-3-ylidene]benzimidazol-4-yl]methyl]ethanamine CAS Name: N-ethyl-N-[[(2Z)-2-[5-(4-isoquinolinyl)-1,2-dihydroindazol-3-ylidene]-4-benzimidazolyl]methyl]ethanamine IUPAC Name: N-ethyl-N-[[(2Z)-2-(5-isoquinolin-4-yl-1,2-dihydroindazol-3-ylidene)benzimidazol-4-yl]methyl]ethanamine Traditional Name: diethyl-[[(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:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26N6/c1-3-34(4-2)17-20-9-7-11-25-26(20)31-28(30-25)27-22-14-18(12-13-24(22)32-33-27)23-16-29-15-19-8-5-6-10-21(19)23/h5-16,32-33H,3-4,17H2,1-2H3/b28-27-