4-[3-(benzimidazol-2-ylidene)-1,2-dihydroindazol-5-yl]-N-(phenylmethyl)isoquinolin-8-amine

Systemtic Name: 4-[3-(benzimidazol-2-ylidene)-1,2-dihydroindazol-5-yl]-N-(phenylmethyl)isoquinolin-8-amine Openeye Name: 4-[3-(benzimidazol-2-ylidene)-1,2-dihydroindazol-5-yl]-N-benzyl-isoquinolin-8-amine CAS Name: 4-[3-(2-benzimidazolylidene)-1,2-dihydroindazol-5-yl]-N-(phenylmethyl)-8-isoquinolinamine IUPAC Name: 4-[3-(benzimidazol-2-ylidene)-1,2-dihydroindazol-5-yl]-N-benzylisoquinolin-8-amine Traditional Name: [4-[3-(benzimidazol-2-ylidene)indazolin-5-yl]-8-isoquinolyl]-benzyl-amine Formula: C30H22N6 MolecularWeight: 466.53588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC=CC3=C(C=NC=C32)C4=CC5=C(C=C4)NNC5=C6N=C7C=CC=CC7=N6

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC=CC3=C(C=NC=C32)C4=CC5=C(C=C4)NNC5=C6N=C7C=CC=CC7=N6

InChI

InChI=1S/C30H22N6/c1-2-7-19(8-3-1)16-32-25-12-6-9-21-23(17-31-18-24(21)25)20-13-14-26-22(15-20)29(36-35-26)30-33-27-10-4-5-11-28(27)34-30/h1-15,17-18,32,35-36H,16H2