[[(3Z)-5-isoquinolin-4-yl-3-[4-(methylaminomethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methyl-phosphanyl]boron

Systemtic Name: [[(3Z)-5-isoquinolin-4-yl-3-[4-(methylaminomethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methyl-phosphanyl]boron Openeye Name: [[(3Z)-5-(4-isoquinolyl)-3-[4-(methylaminomethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methyl-phosphanyl]boron CAS Name: [[(3Z)-5-(4-isoquinolinyl)-3-[4-(methylaminomethyl)-2-benzimidazolylidene]-2H-indazol-1-yl]-methylphosphino]boron IUPAC Name: [[(3Z)-5-isoquinolin-4-yl-3-[4-(methylaminomethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methylphosphanyl]boron Traditional Name: [[(3Z)-5-(4-isoquinolyl)-3-[4-(methylaminomethyl)benzimidazol-2-ylidene]indazolin-1-yl]-methyl-phosphino]boron Formula: C26H22BN6P MolecularWeight: 460.277841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B]P(C)N1C2=C(C=C(C=C2)C3=CN=CC4=CC=CC=C43)C(=C5N=C6C=CC=C(C6=N5)CNC)N1

Isomeric SMILES

[B]P(C)N1C2=C(C=C(C=C2)C3=CN=CC4=CC=CC=C43)/C(=C/5\N=C6C=CC=C(C6=N5)CNC)/N1

InChI

InChI=1S/C26H22BN6P/c1-28-13-18-7-5-9-22-24(18)31-26(30-22)25-20-12-16(10-11-23(20)33(32-25)34(2)27)21-15-29-14-17-6-3-4-8-19(17)21/h3-12,14-15,28,32H,13H2,1-2H3/b26-25-