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

Systemtic Name: [[(3Z)-5-isoquinolin-4-yl-3-[4-(2-pyrrolidin-1-ylethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methyl-phosphanyl]boron Openeye Name: [[(3Z)-5-(4-isoquinolyl)-3-[4-(2-pyrrolidin-1-ylethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methyl-phosphanyl]boron CAS Name: [[(3Z)-5-(4-isoquinolinyl)-3-[4-[2-(1-pyrrolidinyl)ethyl]-2-benzimidazolylidene]-2H-indazol-1-yl]-methylphosphino]boron IUPAC Name: [[(3Z)-5-isoquinolin-4-yl-3-[4-(2-pyrrolidin-1-ylethyl)benzimidazol-2-ylidene]-2H-indazol-1-yl]-methylphosphanyl]boron Traditional Name: [[(3Z)-5-(4-isoquinolyl)-3-[4-(2-pyrrolidinoethyl)benzimidazol-2-ylidene]indazolin-1-yl]-methyl-phosphino]boron Formula: C30H28BN6P MolecularWeight: 514.368281

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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)CCN7CCCC7)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)CCN7CCCC7)/N1

InChI

InChI=1S/C30H28BN6P/c1-38(31)37-27-12-11-21(25-19-32-18-22-7-2-3-9-23(22)25)17-24(27)29(35-37)30-33-26-10-6-8-20(28(26)34-30)13-16-36-14-4-5-15-36/h2-3,6-12,17-19,35H,4-5,13-16H2,1H3/b30-29-