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

Systemtic Name: [[(3Z)-3-[4-(ethylaminomethyl)benzimidazol-2-ylidene]-5-isoquinolin-4-yl-2H-indazol-1-yl]-methyl-phosphanyl]boron Openeye Name: [[(3Z)-3-[4-(ethylaminomethyl)benzimidazol-2-ylidene]-5-(4-isoquinolyl)-2H-indazol-1-yl]-methyl-phosphanyl]boron CAS Name: [[(3Z)-3-[4-(ethylaminomethyl)-2-benzimidazolylidene]-5-(4-isoquinolinyl)-2H-indazol-1-yl]-methylphosphino]boron IUPAC Name: [[(3Z)-3-[4-(ethylaminomethyl)benzimidazol-2-ylidene]-5-isoquinolin-4-yl-2H-indazol-1-yl]-methylphosphanyl]boron Traditional Name: [[(3Z)-3-[4-(ethylaminomethyl)benzimidazol-2-ylidene]-5-(4-isoquinolyl)indazolin-1-yl]-methyl-phosphino]boron Formula: C27H24BN6P MolecularWeight: 474.304421

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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)CNCC)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)CNCC)/N1

InChI

InChI=1S/C27H24BN6P/c1-3-29-15-19-8-6-10-23-25(19)32-27(31-23)26-21-13-17(11-12-24(21)34(33-26)35(2)28)22-16-30-14-18-7-4-5-9-20(18)22/h4-14,16,29,33H,3,15H2,1-2H3/b27-26-